(4-Oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl)acetic acid

2-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)acetic acid

Also Known As: (4-Oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl)acetic acid|KS-00002A2D|5862AD|2-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)acetic acid|Benzo[b]perhydrothiazepin-4-one-3-acetic acid|PS-3918|1,5-Benzothiazepine-3-aceticacid, 2,3,4,5-tetrahydro-4-oxo-|2-(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl)acetic acid|2-(4-Oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl)acetic acid|J2.430.225C|AI-204/31719028|I01-21553|1,5-benzothiazepine-3-acetic acid, 2,3,4,5-tetrahydro-4-oxo-|2-(4-Oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl)aceticacid|(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)acetic acid|1,5-Benzothiazepine-3-aceticacid,2,3,4,5-tetrahydro-4-oxo|2-(4-oxo-2H,3H,5H-benzo[b]1,4-thiazepin-3-yl)acetic acid|4-Oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-3-acetic acid|(4-Oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl)acetic acid #|(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl)acetic acid, AldrichCPR

Molecular Formula	C11H11NO3S
Molecular Weight	237.04596 g/mol
LogP	0.8
Topological Polar Surface Area	91.7 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	237.04596
Monoisotopic Mass	237.04596
Heavy Atoms	16
Complexity	295.0

Chemical Identifiers

CAS Number	17547-79-4
SMILES	C1C(C(=O)NC2=CC=CC=C2S1)CC(=O)O
InChIKey	VCSCQLDBPVHQPW-UHFFFAOYSA-N