N-tert-butyl-2-[7-(diethylsulfamoyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-tert-butyl-2-[7-(diethylsulfamoyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-tert-butyl-2-[7-(diethylsulfamoyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G640-0013 |
| Compound Name: | N-tert-butyl-2-[7-(diethylsulfamoyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 427.58 |
| Molecular Formula: | C19 H29 N3 O4 S2 |
| Smiles: | CCN(CC)S(c1ccc2c(c1)N(CC(NC(C)(C)C)=O)C(CCS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.895 |
| logD: | 2.8949 |
| logSw: | -3.5097 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.613 |
| InChI Key: | PEQARVLMLQENFH-UHFFFAOYSA-N |