N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-3-phenylpropanamide
Chemical Structure Depiction of
N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-3-phenylpropanamide
N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | P895-0104 |
| Compound Name: | N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-3-phenylpropanamide |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C22 H19 N3 O2 S |
| Smiles: | CN1C(c2cccnc2Sc2cc(ccc12)NC(CCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4972 |
| logD: | 3.4971 |
| logSw: | -3.8593 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.368 |
| InChI Key: | SJAXTKMSUWQUPH-UHFFFAOYSA-N |