10-[(4-ethoxyphenyl)methyl]-11-oxo-N-(2-phenylethyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(4-ethoxyphenyl)methyl]-11-oxo-N-(2-phenylethyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(4-ethoxyphenyl)methyl]-11-oxo-N-(2-phenylethyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C380-0776 |
| Compound Name: | 10-[(4-ethoxyphenyl)methyl]-11-oxo-N-(2-phenylethyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C31 H28 N2 O3 S |
| Smiles: | CCOc1ccc(CN2C(c3ccccc3Sc3ccc(cc23)C(NCCc2ccccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1468 |
| logD: | 6.1468 |
| logSw: | -5.4273 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.779 |
| InChI Key: | GIWJQGNAUKTWLX-UHFFFAOYSA-N |