N-[2-(4-benzylpiperazin-1-yl)ethyl]-10-[(3-chlorophenyl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
					Chemical Structure Depiction of
N-[2-(4-benzylpiperazin-1-yl)ethyl]-10-[(3-chlorophenyl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
			N-[2-(4-benzylpiperazin-1-yl)ethyl]-10-[(3-chlorophenyl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K788-8605 | 
| Compound Name: | N-[2-(4-benzylpiperazin-1-yl)ethyl]-10-[(3-chlorophenyl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide | 
| Molecular Weight: | 629.18 | 
| Molecular Formula: | C34 H33 Cl N4 O4 S | 
| Smiles: | C(CN1CCN(CC1)Cc1ccccc1)NC(c1ccc2c(c1)N(Cc1cccc(c1)[Cl])C(c1ccccc1S2(=O)=O)=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 4.374 | 
| logD: | 4.2355 | 
| logSw: | -4.4741 | 
| Hydrogen bond acceptors count: | 10 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 76.159 | 
| InChI Key: | YPHHTXBWTNDBGW-UHFFFAOYSA-N | 
 
				 
				