N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)pyridine-3-carboxamide
Chemical Structure Depiction of
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)pyridine-3-carboxamide
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)pyridine-3-carboxamide
Compound characteristics
| Compound ID: | P895-0239 |
| Compound Name: | N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)pyridine-3-carboxamide |
| Molecular Weight: | 376.44 |
| Molecular Formula: | C20 H16 N4 O2 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)NC(c1cccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8093 |
| logD: | 2.8092 |
| logSw: | -3.4082 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.058 |
| InChI Key: | ITQFRFLAFVAGFH-UHFFFAOYSA-N |