N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-2-(2-methylphenoxy)acetamide
Chemical Structure Depiction of
N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-2-(2-methylphenoxy)acetamide
N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-2-(2-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | P895-0130 |
| Compound Name: | N-(6-methyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)-2-(2-methylphenoxy)acetamide |
| Molecular Weight: | 405.47 |
| Molecular Formula: | C22 H19 N3 O3 S |
| Smiles: | Cc1ccccc1OCC(Nc1ccc2c(c1)Sc1c(cccn1)C(N2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6301 |
| logD: | 3.6301 |
| logSw: | -3.9945 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.954 |
| InChI Key: | LKBXYNCZGFGMAS-UHFFFAOYSA-N |