6-ethyl-5-oxo-N-[(pyridin-3-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
6-ethyl-5-oxo-N-[(pyridin-3-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
6-ethyl-5-oxo-N-[(pyridin-3-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0399 |
| Compound Name: | 6-ethyl-5-oxo-N-[(pyridin-3-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C21 H18 N4 O2 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)C(NCc1cccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3863 |
| logD: | 2.3862 |
| logSw: | -2.6547 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.381 |
| InChI Key: | SBIVLGVRFWKUCK-UHFFFAOYSA-N |