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ChemicalBook--->CAS DataBase List--->1190389-15-1

1190389-15-1

1190389-15-1 Structure

1190389-15-1 Structure
IdentificationBack Directory
[Name]

MB-07133
[CAS]

1190389-15-1
[Synonyms]

RVT-901
KRP-114V
Vibegron-13C-D4
Vibegron (MK-4618)
(6S)-4,6,7,8-Tetrahydro-N-[4-[[(2S,5R)-5-[(R)-hydroxyphenylmethyl]-2-pyrrolidinyl]methyl]phenyl]-4-oxopyrrolo[1,2-a]pyrimidine-6-carboxamide
Pyrrolo[1,2-a]pyrimidine-6-carboxamide, 4,6,7,8-tetrahydro-N-[4-[[(2S,5R)-5-[(R)-hydroxyphenylmethyl]-2-pyrrolidinyl]methyl]phenyl]-4-oxo-, (6S)-
[Molecular Formula]

C26H28N4O3
[MDL Number]

MFCD28502057
[MOL File]

1190389-15-1.mol
[Molecular Weight]

444.53
Chemical PropertiesBack Directory
[density ]

1.36±0.1 g/cm3(Predicted)
[storage temp. ]

4°C, away from moisture and light
[form ]

Solid
[pka]

13.55±0.70(Predicted)
[color ]

White to off-white
[InChIKey]

DJXRIQMCROIRCZ-XOEOCAAJSA-N
[SMILES]

C12CC[C@@H](C(NC3=CC=C(C[C@@H]4CC[C@H]([C@H](O)C5=CC=CC=C5)N4)C=C3)=O)N1C(=O)C=CN=2
Hazard InformationBack Directory
[Uses]

Vibegron is a potent and selective β3 Adrenergic receptor agonist for the treatment of overactive bladder.
[Definition]

ChEBI: Vibegron is a pyrrolopyrimidine obtained by formal condensation of the carboxy group of (6S)-4-oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxylic acid with the amino group of (R)-[(2R,5S)-5-(4-aminobenzyl)pyrrolidin-2-yl](phenyl)methanol. It is a beta3-adrenergic receptor agonist currently in clinical development for the treatment of patients with overactive bladder. It has a role as a beta-adrenergic agonist. It is a secondary alcohol, a member of pyrrolidines, a member of benzenes, a secondary carboxamide, a pyrrolopyrimidine and a secondary amine.
[storage]

4°C, away from moisture and light
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