4-ethyl-N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
Chemical Structure Depiction of
4-ethyl-N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
4-ethyl-N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide
Compound characteristics
| Compound ID: | P895-0144 |
| Compound Name: | 4-ethyl-N-(6-ethyl-5-oxo-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl)benzamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Smiles: | CCc1ccc(cc1)C(Nc1ccc2c(c1)Sc1c(cccn1)C(N2CC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.928 |
| logD: | 4.928 |
| logSw: | -4.4698 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.541 |
| InChI Key: | DJMIETAJPZZODL-UHFFFAOYSA-N |