N-[2-(azepan-1-yl)ethyl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C648-0274 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 464.58 |
| Molecular Formula: | C22 H32 N4 O5 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCCC(C1)C(NCCN1CCCCCC1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6005 |
| logD: | -0.1822 |
| logSw: | -2.5753 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.317 |
| InChI Key: | NSRTVDPOPBNHQT-KRWDZBQOSA-N |