6-methyl-N-[(3-methylphenyl)methyl]-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
6-methyl-N-[(3-methylphenyl)methyl]-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
6-methyl-N-[(3-methylphenyl)methyl]-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0321 |
| Compound Name: | 6-methyl-N-[(3-methylphenyl)methyl]-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C22 H19 N3 O2 S |
| Smiles: | Cc1cccc(CNC(c2ccc3c(c2)Sc2c(cccn2)C(N3C)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4263 |
| logD: | 3.4263 |
| logSw: | -3.7991 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.904 |
| InChI Key: | AIRHZRMQHVVQJW-UHFFFAOYSA-N |