N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)thiophene-3-carboxamide
Chemical Structure Depiction of
N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)thiophene-3-carboxamide
N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)thiophene-3-carboxamide
Compound characteristics
| Compound ID: | P895-0020 |
| Compound Name: | N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)thiophene-3-carboxamide |
| Molecular Weight: | 367.45 |
| Molecular Formula: | C18 H13 N3 O2 S2 |
| Smiles: | CN1C(c2cccnc2Sc2cc(ccc12)NC(c1ccsc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8864 |
| logD: | 2.8864 |
| logSw: | -3.7303 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.6 |
| InChI Key: | HKKCANXWJFARDB-UHFFFAOYSA-N |