5-oxo-6-(propan-2-yl)-N-[(pyridin-2-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
5-oxo-6-(propan-2-yl)-N-[(pyridin-2-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
5-oxo-6-(propan-2-yl)-N-[(pyridin-2-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0568 |
| Compound Name: | 5-oxo-6-(propan-2-yl)-N-[(pyridin-2-yl)methyl]-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C22 H20 N4 O2 S |
| Smiles: | CC(C)N1C(c2cccnc2Sc2cc(ccc12)C(NCc1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.95 |
| logD: | 2.9499 |
| logSw: | -3.6146 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.402 |
| InChI Key: | ZJTFNLNIKDJREM-UHFFFAOYSA-N |