N-[2-(3,4-dimethoxyphenyl)ethyl]-10-[(2-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-10-[(2-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-10-[(2-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K786-7285 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-10-[(2-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 538.67 |
| Molecular Formula: | C32 H30 N2 O4 S |
| Smiles: | Cc1ccccc1CN1C(c2ccccc2Sc2ccc(cc12)C(NCCc1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9135 |
| logD: | 5.9135 |
| logSw: | -5.4191 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.916 |
| InChI Key: | ISTRSHXOXJJYKW-UHFFFAOYSA-N |