N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-2466 |
| Compound Name: | N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 433.59 |
| Molecular Formula: | C21 H27 N3 O3 S2 |
| Smiles: | CCN(CCNS(c1ccc2c(c1)NC(CC(C)S2)=O)(=O)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2526 |
| logD: | 3.0801 |
| logSw: | -3.5608 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.676 |
| InChI Key: | FOTFNYAWWVIWRN-MRXNPFEDSA-N |