2-ethoxy-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
Chemical Structure Depiction of
2-ethoxy-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
2-ethoxy-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide
Compound characteristics
Compound ID: | P895-0256 |
Compound Name: | 2-ethoxy-N-[5-oxo-6-(propan-2-yl)-5,6-dihydropyrido[2,3-b][1,5]benzothiazepin-9-yl]benzamide |
Molecular Weight: | 433.53 |
Molecular Formula: | C24 H23 N3 O3 S |
Smiles: | CCOc1ccccc1C(Nc1ccc2c(c1)Sc1c(cccn1)C(N2C(C)C)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5221 |
logD: | 4.5217 |
logSw: | -4.2565 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.747 |
InChI Key: | AHXFIZRAHCBTNF-UHFFFAOYSA-N |