2-[7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
2-[7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | G640-0300 |
| Compound Name: | 2-[7-(4-methylpiperidine-1-sulfonyl)-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 481.63 |
| Molecular Formula: | C22 H31 N3 O5 S2 |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)N(CC(NCC1CCCO1)=O)C(CCS2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1649 |
| logD: | 2.1649 |
| logSw: | -2.8418 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.787 |
| InChI Key: | LGIJIYZIQVEOGI-QGZVFWFLSA-N |