N-benzyl-2-methyl-4-oxo-N-(2-phenylethyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-benzyl-2-methyl-4-oxo-N-(2-phenylethyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-benzyl-2-methyl-4-oxo-N-(2-phenylethyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-1592 |
| Compound Name: | N-benzyl-2-methyl-4-oxo-N-(2-phenylethyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 466.62 |
| Molecular Formula: | C25 H26 N2 O3 S2 |
| Smiles: | CC1CC(Nc2cc(ccc2S1)S(N(CCc1ccccc1)Cc1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.872 |
| logD: | 4.8716 |
| logSw: | -4.5223 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.472 |
| InChI Key: | PHHNNDKAXVXJLY-LJQANCHMSA-N |