5-acetyl-N-(butan-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
5-acetyl-N-(butan-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
5-acetyl-N-(butan-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G269-0029 |
| Compound Name: | 5-acetyl-N-(butan-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 342.48 |
| Molecular Formula: | C15 H22 N2 O3 S2 |
| Smiles: | CCC(C)NS(c1ccc2c(c1)N(CCCS2)C(C)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8446 |
| logD: | 2.8445 |
| logSw: | -3.5215 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.306 |
| InChI Key: | JDWITMIRXXXVAC-NSHDSACASA-N |