2-ethoxy-N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
Chemical Structure Depiction of
2-ethoxy-N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
2-ethoxy-N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
Compound characteristics
| Compound ID: | P895-0139 |
| Compound Name: | 2-ethoxy-N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C23 H21 N3 O3 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)NC(c1ccccc1OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2762 |
| logD: | 4.2759 |
| logSw: | -4.2162 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.751 |
| InChI Key: | FQHGWVKPYRSIIQ-UHFFFAOYSA-N |