1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}-N-phenylpiperidine-3-carboxamide
Chemical Structure Depiction of
1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}-N-phenylpiperidine-3-carboxamide
1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}-N-phenylpiperidine-3-carboxamide
Compound characteristics
Compound ID: | F061-1952 |
Compound Name: | 1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}-N-phenylpiperidine-3-carboxamide |
Molecular Weight: | 493.62 |
Molecular Formula: | C27 H31 N3 O4 S |
Smiles: | Cc1cc(C)c(/C=C/c2c(c(C)no2)S(N2CCCC(C2)C(Nc2ccccc2)=O)(=O)=O)c(C)c1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.511 |
logD: | 4.511 |
logSw: | -4.1877 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.49 |
InChI Key: | NBBXFYXPOXWOID-QFIPXVFZSA-N |