6-ethyl-N-(2-fluorophenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
6-ethyl-N-(2-fluorophenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
6-ethyl-N-(2-fluorophenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0413 |
| Compound Name: | 6-ethyl-N-(2-fluorophenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C21 H16 F N3 O2 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)C(Nc1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9265 |
| logD: | 3.9176 |
| logSw: | -3.9529 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.843 |
| InChI Key: | BYUFYVMEGFALJA-UHFFFAOYSA-N |