2-(furan-2-yl)-5-[(4-nitrophenyl)methyl]-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
					Chemical Structure Depiction of
2-(furan-2-yl)-5-[(4-nitrophenyl)methyl]-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
			2-(furan-2-yl)-5-[(4-nitrophenyl)methyl]-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Compound characteristics
| Compound ID: | C714-0646 | 
| Compound Name: | 2-(furan-2-yl)-5-[(4-nitrophenyl)methyl]-2,3-dihydro-1,5-benzothiazepin-4(5H)-one | 
| Molecular Weight: | 380.42 | 
| Molecular Formula: | C20 H16 N2 O4 S | 
| Smiles: | C1C(c2ccco2)Sc2ccccc2N(Cc2ccc(cc2)[N+]([O-])=O)C1=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 4.508 | 
| logD: | 4.508 | 
| logSw: | -4.4211 | 
| Hydrogen bond acceptors count: | 8 | 
| Polar surface area: | 57.638 | 
| InChI Key: | ZLFDGQRVHCDECZ-IBGZPJMESA-N | 
 
				 
				