3-methyl-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
3-methyl-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
3-methyl-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-3284 |
| Compound Name: | 3-methyl-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 397.51 |
| Molecular Formula: | C17 H23 N3 O4 S2 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(NCCCN1CCCC1=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0121 |
| logD: | 1.0116 |
| logSw: | -2.4682 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.559 |
| InChI Key: | AEORWJSDOWROMN-GFCCVEGCSA-N |