N-[(furan-2-yl)methyl]-N-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-[(furan-2-yl)methyl]-N-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | E975-1652 |
| Compound Name: | N-[(furan-2-yl)methyl]-N-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C15 H16 N2 O4 S2 |
| Smiles: | CN(Cc1ccco1)S(c1ccc2c(c1)NC(CCS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0347 |
| logD: | 2.0345 |
| logSw: | -2.9794 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.703 |
| InChI Key: | PXWXTTCQCWIVLN-UHFFFAOYSA-N |