10-[(2,5-dimethylphenyl)methyl]-5,5,11-trioxo-N-[(oxolan-2-yl)methyl]-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
					Chemical Structure Depiction of
10-[(2,5-dimethylphenyl)methyl]-5,5,11-trioxo-N-[(oxolan-2-yl)methyl]-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
			10-[(2,5-dimethylphenyl)methyl]-5,5,11-trioxo-N-[(oxolan-2-yl)methyl]-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C530-1390 | 
| Compound Name: | 10-[(2,5-dimethylphenyl)methyl]-5,5,11-trioxo-N-[(oxolan-2-yl)methyl]-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide | 
| Molecular Weight: | 504.6 | 
| Molecular Formula: | C28 H28 N2 O5 S | 
| Smiles: | Cc1ccc(C)c(CN2C(c3ccccc3S(c3ccc(cc23)C(NCC2CCCO2)=O)(=O)=O)=O)c1 | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 3.8314 | 
| logD: | 3.8314 | 
| logSw: | -3.8602 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 77.449 | 
| InChI Key: | PZXXMEVSVUWOCY-JOCHJYFZSA-N | 
 
				 
				