N-[4-(1,2-oxazol-5-yl)phenyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-[4-(1,2-oxazol-5-yl)phenyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-[4-(1,2-oxazol-5-yl)phenyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | E975-1643 |
| Compound Name: | N-[4-(1,2-oxazol-5-yl)phenyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C18 H15 N3 O4 S2 |
| Smiles: | C1CSc2ccc(cc2NC1=O)S(Nc1ccc(cc1)c1ccno1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3344 |
| logD: | 2.3232 |
| logSw: | -3.0473 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.909 |
| InChI Key: | AWRZGNJZWDNQDG-UHFFFAOYSA-N |