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308242-23-1

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308242-23-1 Structure

308242-23-1 Structure
IdentificationBack Directory
[Name]

(3S)-(7-BroMo-2-oxo-5-pyridin-2-yl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-propionic acid Methyl ester
[CAS]

308242-23-1
[Synonyms]

Methyl 3-[(3S)-7-bromo-2-oxo-5-(2-pyridinyl)-2,3-dihydro-1H-1,4-benzodiazepin-3-yl]propanoate
(S)-Methyl 3-(7-bromo-2-oxo-5-(pyridin-2-yl)-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)propanoate
3-[(S)-7-bromo-2-oxo-5-pyridin-2-yl-2,3-dihydro-1H-1,4-benzodiazepin-3-yl]-propionic acid methyl ester
1H-1,4-Benzodiazepine-3-propanoic acid, 7-bromo-2,3-dihydro-2-oxo-5-(2-pyridinyl)-, methyl ester, (3S)-
(3S)-(7-BroMo-2-oxo-5-pyridin-2-yl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-propionic acid Methyl ester
[Molecular Formula]

C18H16BrN3O3
[MOL File]

308242-23-1.mol
[Molecular Weight]

402.24
Chemical PropertiesBack Directory
[Boiling point ]

545.3±50.0 °C(Predicted)
[density ]

1.52±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

11.15±0.70(Predicted)
[Appearance]

Off-white to light yellow Solid
[Optical Rotation]

233.5°(C=1.0g/100ml DMF)
[InChI]

InChI=1S/C18H16BrN3O3/c1-25-16(23)8-7-15-18(24)22-13-6-5-11(19)10-12(13)17(21-15)14-4-2-3-9-20-14/h2-6,9-10,15H,7-8H2,1H3,(H,22,24)/t15-/m0/s1
[InChIKey]

PITXBYGUVDYTBQ-HNNXBMFYSA-N
[SMILES]

N1C2=CC=C(Br)C=C2C(C2=NC=CC=C2)=N[C@@H](CCC(OC)=O)C1=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[REACH Registrations]

Inactive
Spectrum DetailBack Directory
[Spectrum Detail]

(3S)-(7-BroMo-2-oxo-5-pyridin-2-yl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-propionic acid Methyl ester(308242-23-1)1HNMR
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