10-[(2-methylphenyl)methyl]-11-oxo-N-[(pyridin-3-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-[(2-methylphenyl)methyl]-11-oxo-N-[(pyridin-3-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
10-[(2-methylphenyl)methyl]-11-oxo-N-[(pyridin-3-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K786-7278 |
| Compound Name: | 10-[(2-methylphenyl)methyl]-11-oxo-N-[(pyridin-3-yl)methyl]-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C28 H23 N3 O2 S |
| Smiles: | Cc1ccccc1CN1C(c2ccccc2Sc2ccc(cc12)C(NCc1cccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2352 |
| logD: | 5.2351 |
| logSw: | -4.7651 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.332 |
| InChI Key: | XVSSYSFTVVKFAZ-UHFFFAOYSA-N |