5-acetyl-N-[3-(diethylamino)propyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
5-acetyl-N-[3-(diethylamino)propyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
5-acetyl-N-[3-(diethylamino)propyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G269-0046 |
| Compound Name: | 5-acetyl-N-[3-(diethylamino)propyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 399.57 |
| Molecular Formula: | C18 H29 N3 O3 S2 |
| Smiles: | CCN(CC)CCCNS(c1ccc2c(c1)N(CCCS2)C(C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6376 |
| logD: | 0.3286 |
| logSw: | -3.1508 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.904 |
| InChI Key: | WBENQNMSHSTEQH-UHFFFAOYSA-N |