N-[2-(4-chlorophenyl)ethyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
N-[2-(4-chlorophenyl)ethyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Compound characteristics
Compound ID: | G305-1243 |
Compound Name: | N-[2-(4-chlorophenyl)ethyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide |
Molecular Weight: | 463.94 |
Molecular Formula: | C21 H22 Cl N3 O5 S |
Smiles: | C1CC(CN(C1)S(c1ccc2c(c1)OC(N2)=O)(=O)=O)C(NCCc1ccc(cc1)[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4544 |
logD: | 2.4208 |
logSw: | -3.6137 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 89.555 |
InChI Key: | CCUXPWSCOYRGMJ-HNNXBMFYSA-N |