5-acetyl-N-[3-(1,2-oxazol-5-yl)phenyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
5-acetyl-N-[3-(1,2-oxazol-5-yl)phenyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
5-acetyl-N-[3-(1,2-oxazol-5-yl)phenyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G269-0265 |
| Compound Name: | 5-acetyl-N-[3-(1,2-oxazol-5-yl)phenyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C20 H19 N3 O4 S2 |
| Smiles: | CC(N1CCCSc2ccc(cc12)S(Nc1cccc(c1)c1ccno1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2628 |
| logD: | 3.2602 |
| logSw: | -3.747 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.14 |
| InChI Key: | SCVXRMGBXJLCFU-UHFFFAOYSA-N |