N-[(furan-2-yl)methyl]-N,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-[(furan-2-yl)methyl]-N,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-1852 |
| Compound Name: | N-[(furan-2-yl)methyl]-N,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C16 H18 N2 O4 S2 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(N(C)Cc1ccco1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6807 |
| logD: | 2.6802 |
| logSw: | -3.2382 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.76 |
| InChI Key: | XXKMCBWPCODHCP-LLVKDONJSA-N |