2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | G290-0122 |
| Compound Name: | 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C22 H20 N4 O4 S2 |
| Smiles: | C(CNC(CN1C(c2cccnc2Sc2ccccc12)=O)=O)c1ccc(cc1)S(N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3987 |
| logD: | 1.398 |
| logSw: | -2.5221 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.369 |
| InChI Key: | BNMBPJFYSATOAH-UHFFFAOYSA-N |