N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)acetamide
Chemical Structure Depiction of
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)acetamide
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)acetamide
Compound characteristics
| Compound ID: | P895-0240 |
| Compound Name: | N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)acetamide |
| Molecular Weight: | 313.38 |
| Molecular Formula: | C16 H15 N3 O2 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3675 |
| logD: | 2.3675 |
| logSw: | -3.0192 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.711 |
| InChI Key: | WCKNRTNTBHEOEJ-UHFFFAOYSA-N |