N-cyclohexyl-N-methyl-2-[2-methyl-7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Chemical Structure Depiction of
N-cyclohexyl-N-methyl-2-[2-methyl-7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
N-cyclohexyl-N-methyl-2-[2-methyl-7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide
Compound characteristics
| Compound ID: | G640-1134 |
| Compound Name: | N-cyclohexyl-N-methyl-2-[2-methyl-7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetamide |
| Molecular Weight: | 507.71 |
| Molecular Formula: | C25 H37 N3 O4 S2 |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)N(CC(N(C)C1CCCCC1)=O)C(CC(C)S2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0937 |
| logD: | 4.0937 |
| logSw: | -4.1341 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 62.607 |
| InChI Key: | JESCZFSTSRBWBQ-LJQANCHMSA-N |