6-methyl-N-(4-methylphenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
6-methyl-N-(4-methylphenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
6-methyl-N-(4-methylphenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0227 |
| Compound Name: | 6-methyl-N-(4-methylphenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 375.45 |
| Molecular Formula: | C21 H17 N3 O2 S |
| Smiles: | Cc1ccc(cc1)NC(c1ccc2c(c1)Sc1c(cccn1)C(N2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4953 |
| logD: | 3.4951 |
| logSw: | -3.8768 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.582 |
| InChI Key: | IJHNBDFRUHAJDN-UHFFFAOYSA-N |