N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)thiophene-3-carboxamide
Chemical Structure Depiction of
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)thiophene-3-carboxamide
N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)thiophene-3-carboxamide
Compound characteristics
| Compound ID: | P895-0148 |
| Compound Name: | N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)thiophene-3-carboxamide |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C19 H15 N3 O2 S2 |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)NC(c1ccsc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7626 |
| logD: | 3.7626 |
| logSw: | -3.9427 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.559 |
| InChI Key: | BWBUDBPMISRIRA-UHFFFAOYSA-N |