N-(3-methoxyphenyl)-6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Chemical Structure Depiction of
N-(3-methoxyphenyl)-6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
N-(3-methoxyphenyl)-6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide
Compound characteristics
| Compound ID: | P617-0234 |
| Compound Name: | N-(3-methoxyphenyl)-6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepine-9-carboxamide |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C21 H17 N3 O3 S |
| Smiles: | CN1C(c2cccnc2Sc2cc(ccc12)C(Nc1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1383 |
| logD: | 3.1372 |
| logSw: | -3.6469 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.125 |
| InChI Key: | YPMKBXFLAFJFFN-UHFFFAOYSA-N |