6-ethyl-N-(3-fluoro-4-methoxyphenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
6-ethyl-N-(3-fluoro-4-methoxyphenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
6-ethyl-N-(3-fluoro-4-methoxyphenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0460 |
| Compound Name: | 6-ethyl-N-(3-fluoro-4-methoxyphenyl)-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 423.46 |
| Molecular Formula: | C22 H18 F N3 O3 S |
| Smiles: | CCN1C(c2cccnc2Sc2cc(ccc12)C(Nc1ccc(c(c1)F)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0389 |
| logD: | 4.0207 |
| logSw: | -4.216 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.171 |
| InChI Key: | ZRJSWXSPVDBCLT-UHFFFAOYSA-N |