N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-2425 |
| Compound Name: | N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 487.68 |
| Molecular Formula: | C25 H33 N3 O3 S2 |
| Smiles: | CC1CC(Nc2cc(ccc2S1)S(NCC1CCN(CC1)Cc1cc(C)ccc1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8244 |
| logD: | 2.9718 |
| logSw: | -4.4489 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.881 |
| InChI Key: | UIPVDGUAXQOCOY-LJQANCHMSA-N |