ChemicalBook--->CAS DataBase List--->1228088-30-9

1228088-30-9

1228088-30-9 Structure

1228088-30-9 Structure
IdentificationBack Directory
[Name]

Balovaptan
[CAS]

1228088-30-9
[Synonyms]

RG7314
Balovaptan
Balovaptan(RG7314)
RG 7314,Vasopressin Receptor,RG-7314,inhibit,Inhibitor,Balovaptan
trans-8-chloro-5-methyl-1-[4-(pyridin-2-yloxy)cyclohexyl]-5,6-dihydro-4H-2,3,5,10b-tetraazabenzo[e]azulene
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine, 8-chloro-5,6-dihydro-5-methyl-1-[trans-4-(2-pyridinyloxy)cyclohexyl]-
[Molecular Formula]

C22H24ClN5O
[MDL Number]

MFCD31706224
[MOL File]

1228088-30-9.mol
[Molecular Weight]

409.91
Chemical PropertiesBack Directory
[Boiling point ]

597.0±60.0 °C(Predicted)
[density ]

1.39±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO: 62.5 mg/mL (152.47 mM)
[form ]

Solid
[pka]

5.52±0.20(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

Balovaptan (RG7314) is an orally available, selective brain-penetrant vasopressin 1a (hV1a) receptor antagonist, with Kis of 1 and 39 nM for human (hV1a) and mouse (mV1a) receptors, and is used for the research of autism.
[References]

[1] Ratni H, et al. Discovery of highly selective brain-penetrant vasopressin 1a antagonists for the potential treatment of autism via a chemogenomic and scaffold hopping approach. J Med Chem. 2015 Mar 12;58(5):2275-89. DOI:10.1021/jm501745f
Spectrum DetailBack Directory
[Spectrum Detail]

Balovaptan(1228088-30-9)1HNMR
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