ChemicalBook--->CAS DataBase List--->1232416-25-9

1232416-25-9

1232416-25-9 Structure

1232416-25-9 Structure
IdentificationBack Directory
[Name]

VE 822
[CAS]

1232416-25-9
[Synonyms]

VX970
M6620
M-6620
M 6620
VE 822
CS-1487
Berzosertib
VE822; VE 822
VX970 (VE-822)
VE-822 (VX-970)
VE 822 USP/EP/BP
Berzosertib(VE-822)
VE-822 (Berzosertib)
Berzosertib (Synonyms: VE-822
M6620; M-6620; M 6620; VE822; VE-822; VE 822; VX970; VX-970; VX 970;
3-[3-[4-(methylaminomethyl)phenyl]-1,2-oxazol-5-yl]-5-(4-propan-2-ylsulfonylphenyl)pyrazin-2-amine
3-(3-{4-[(methylamino)methyl]phenyl}-1,2-oxazol-5-yl)-5-[4-(propane-2-sulfonyl)phenyl]pyrazin-2-amine
3-[3-[4-[(Methylamino)methyl]phenyl]-5-isoxazolyl]-5-[4-[(1-methylethyl)sulfonyl]phenyl]-2-pyrazinamine
2-Pyrazinamine, 3-[3-[4-[(methylamino)methyl]phenyl]-5-isoxazolyl]-5-[4-[(1-methylethyl)sulfonyl]phenyl]-
3-[3-[4-[(Methylamino)methyl]phenyl]-5-isoxazolyl]-5-[4-[(1-methylethyl)sulfonyl]phenyl]-2-pyrazinamine VE-822
VE 822 3-[3-[4-[(Methylamino)methyl]phenyl]-5-isoxazolyl]-5-[4-[(1-methylethyl)sulfonyl]phenyl]-2-pyrazinamine
[EINECS(EC#)]

1592732-453-0
[Molecular Formula]

C24H25N5O3S
[MDL Number]

MFCD27976794
[MOL File]

1232416-25-9.mol
[Molecular Weight]

463.552
Chemical PropertiesBack Directory
[Melting point ]

>197°C (dec.)
[Boiling point ]

674.4±55.0 °C(Predicted)
[density ]

1.263±0.06 g/cm3(Predicted)
[storage temp. ]

Refrigerator
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

8.88±0.10(Predicted)
[color ]

Light Yellow
[InChIKey]

JZCWLJDSIRUGIN-UHFFFAOYSA-N
[SMILES]

C1(N)=NC=C(C2=CC=C(S(C(C)C)(=O)=O)C=C2)N=C1C1ON=C(C2=CC=C(CNC)C=C2)C=1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
Hazard InformationBack Directory
[Uses]

3-[3-[4-[(Methylamino)methyl]phenyl]-5-isoxazolyl]-5-[4-[(1-methylethyl)sulfonyl]phenyl]-2-pyrazinamine is a novel ATR (ATM-Rad3-related) inhibitor for in vitro and in vivo radiosensatization.
[Definition]

ChEBI: 3-[3-[4-(methylaminomethyl)phenyl]-5-isoxazolyl]-5-(4-propan-2-ylsulfonylphenyl)-2-pyrazinamine is a sulfonamide.
[in vivo]

PSN-1 xenografts are treated with Berzosertib (VE-822) (60 mk/kg; d0, 1), NSC 613327 (100 mg/kg; d0) and/or XRT (6 Gy; d1). Tumors are then harvested 2 h post-XRT. Berzosertib (VE-822) inhibits p-Ser-345-Chk1 in xenografts after DNA-damaging agents, establishing VE-822 as a potent inhibitor of ATR in vivo. Besides, Berzosertib (VE-822) enhances the therapeutic efficacy of radiation (XRT) in MiaPaCa-2 and PSN-1 xenograft models[1].

[IC 50]

ATR: 0.2 nM (Ki); ATM: 34 nM (Ki); PI3Kγ: 220 nM (Ki)
Spectrum DetailBack Directory
[Spectrum Detail]

VE 822(1232416-25-9)MS
VE 822(1232416-25-9)1HNMR
1232416-25-9 suppliers list
Company Name: Hubei Kele Fine Chemical Co., Ltd  Gold
Telephone: 027-59101668 19945030958
Website: www.kerle.cn
Company Name: Changzhou Chenhong Biotechnology Co., Ltd.  Gold
Telephone: +86-0519-85788828 +86-13775037613
Website: http://www.chemrenblock.com/
Company Name: Wuhan Topule  Gold
Telephone: +86-02787215551 19945035818
Website: http://www.topule.com/
Company Name: Olix ( Hubei) Pharmaceutical Technology Co., Ltd  Gold
Telephone: 17316404525 17316404525
Website: www.olix.cn
Company Name: ShangHai ChuanQian Chemcial Technique Centre  Gold
Telephone: 15869524721
Website: www.chemicalbook.com/ShowSupplierProductsList68594/0_EN.htm
Company Name: Shanghai Boyle Chemical Co., Ltd.  
Telephone:
Website: www.boylechem.com
Company Name: WUHAN SUN-SHINE BIO-TECHNOLOGY Co., Ltd.  
Telephone: 17702719238
Website: http://www.sun-shinechem.com/
Company Name: Dalian Meilun Biotech Co., Ltd.  
Telephone: 0411-62910999 13889544652
Website: http://www.meilunbio.com/
Company Name: NCE Biomedical Co.,Ltd.  
Telephone: 4000-027-021 |24 +86-13986109188 | +86-15623472865 | +81-08033611988
Website: www.chemicalbook.com/ShowSupplierProductsList15748/0_EN.htm
Company Name: Haoyuan Chemexpress Co., Ltd.  
Telephone: 021-58950125
Website: http://www.chemexpress.com.cn
Company Name: Candia Thamtech Company Limited  
Telephone: 0371-86615086 18203638366 0371-86159066 13526786601
Website: www.chemicalbook.com/ShowSupplierProductsList15771/0_EN.htm
Company Name: UHN Shanghai Research & Development Co., Ltd.  
Telephone: 021-58958002 18930822973
Website: www.uhnshanghai.com
Company Name: ShangHai Caerulum Pharma Discovery Co., Ltd.  
Telephone: 18149758185 18149758185
Website: www.caerulumpharma.com
Company Name: AdooQ Bioscience CHINA  
Telephone: 025-58849295
Website: http://www.adooq.cn
Company Name: LETOPHARM LIMITED  
Telephone: +86-21-5821 5861
Website: www.letopharm.com
Company Name: Shanghai Lollane Biological Technology Co.,Ltd.  
Telephone: 021-52996696,15000506266 15000506266
Website: http://www.bioll.com
Company Name: Wuhan ChemFaces Biochemical Co., Ltd.  
Telephone: 18607101326 15172504745
Website: www.chemfaces.com
Company Name: SPIRO PHARMA  
Telephone:
Website: www.spiropharma.com.cn
Tags:1232416-25-9 Related Product Information
763113-22-0 925701-49-1 1232410-49-9 179324-69-7 503468-95-9 1629869-44-8 873054-44-5 402957-28-2 297730-17-7 273404-37-8 209410-46-8 129830-38-2