5-acetyl-N,N-dibutyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
5-acetyl-N,N-dibutyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
5-acetyl-N,N-dibutyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G269-0045 |
| Compound Name: | 5-acetyl-N,N-dibutyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 398.59 |
| Molecular Formula: | C19 H30 N2 O3 S2 |
| Smiles: | CCCCN(CCCC)S(c1ccc2c(c1)N(CCCS2)C(C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4815 |
| logD: | 4.4815 |
| logSw: | -4.1748 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.225 |
| InChI Key: | VHBVICTZZLGNDM-UHFFFAOYSA-N |