N-(3-chloro-2-methylphenyl)-4-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
					Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-4-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
			N-(3-chloro-2-methylphenyl)-4-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | L925-0407 | 
| Compound Name: | N-(3-chloro-2-methylphenyl)-4-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide | 
| Molecular Weight: | 494.03 | 
| Molecular Formula: | C22 H24 Cl N3 O4 S2 | 
| Smiles: | Cc1c(cccc1[Cl])NS(c1ccc2c(c1)NC(C(CC(N1CCCC1)=O)CS2)=O)(=O)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 3.5634 | 
| logD: | 2.6283 | 
| logSw: | -3.7191 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 81.886 | 
| InChI Key: | CASZKRWDDWJFLK-OAHLLOKOSA-N | 
 
				 
				