N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-2-(2-methoxyphenoxy)acetamide
Chemical Structure Depiction of
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-2-(2-methoxyphenoxy)acetamide
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-2-(2-methoxyphenoxy)acetamide
Compound characteristics
| Compound ID: | P895-0151 |
| Compound Name: | N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-2-(2-methoxyphenoxy)acetamide |
| Molecular Weight: | 435.5 |
| Molecular Formula: | C23 H21 N3 O4 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)NC(COc1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7787 |
| logD: | 3.7787 |
| logSw: | -3.9111 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.543 |
| InChI Key: | KHAHKBZIPSSQHA-UHFFFAOYSA-N |