N-[(furan-2-yl)methyl]-3-methyl-N-(1-methylpiperidin-4-yl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-3-methyl-N-(1-methylpiperidin-4-yl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-[(furan-2-yl)methyl]-3-methyl-N-(1-methylpiperidin-4-yl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-3446 |
| Compound Name: | N-[(furan-2-yl)methyl]-3-methyl-N-(1-methylpiperidin-4-yl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C21 H27 N3 O4 S2 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(N(Cc1ccco1)C1CCN(C)CC1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8677 |
| logD: | 1.3804 |
| logSw: | -3.4512 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.059 |
| InChI Key: | ZQHUHJJUUJAINF-OAHLLOKOSA-N |