N-[2-(morpholin-4-yl)ethyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-[2-(morpholin-4-yl)ethyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-[2-(morpholin-4-yl)ethyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-2704 |
| Compound Name: | N-[2-(morpholin-4-yl)ethyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 371.48 |
| Molecular Formula: | C15 H21 N3 O4 S2 |
| Smiles: | C1CSc2ccc(cc2NC1=O)S(NCCN1CCOCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6594 |
| logD: | 0.6512 |
| logSw: | -2.4037 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.881 |
| InChI Key: | OUKHCSHMBKTLOL-UHFFFAOYSA-N |