N-(5-chloro-2-methylphenyl)-2-[7-(diethylsulfamoyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-2-[7-(diethylsulfamoyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-(5-chloro-2-methylphenyl)-2-[7-(diethylsulfamoyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G640-0057 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-2-[7-(diethylsulfamoyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 496.05 |
| Molecular Formula: | C22 H26 Cl N3 O4 S2 |
| Smiles: | CCN(CC)S(c1ccc2c(c1)N(CC(Nc1cc(ccc1C)[Cl])=O)C(CCS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9417 |
| logD: | 3.9413 |
| logSw: | -4.246 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.498 |
| InChI Key: | XOFGCEOGLJUHSX-UHFFFAOYSA-N |