N-[2-(3,4-dimethoxyphenyl)ethyl]-10-[(2,5-dimethylphenyl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
					Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-10-[(2,5-dimethylphenyl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
			N-[2-(3,4-dimethoxyphenyl)ethyl]-10-[(2,5-dimethylphenyl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C529-0980 | 
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-10-[(2,5-dimethylphenyl)methyl]-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide | 
| Molecular Weight: | 568.69 | 
| Molecular Formula: | C33 H32 N2 O5 S | 
| Smiles: | Cc1ccc(C)c(CN2C(c3ccccc3S(c3ccc(cc23)C(NCCc2ccc(c(c2)OC)OC)=O)=O)=O)c1 | 
| Stereo: | ACHIRAL | 
| logP: | 4.6017 | 
| logD: | 4.6017 | 
| logSw: | -4.302 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 70.3 | 
| InChI Key: | QMPMTICQNRGFGP-UHFFFAOYSA-N | 
 
				 
				