N-methyl-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-methyl-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-methyl-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
Compound ID: | K906-3615 |
Compound Name: | N-methyl-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
Molecular Weight: | 403.5 |
Molecular Formula: | C20 H25 N3 O4 S |
Smiles: | Cc1ccc(/C=C/c2c(c(C)no2)S(N2CCC(CC2)C(NC)=O)(=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 2.2111 |
logD: | 2.2111 |
logSw: | -2.6735 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.3 |
InChI Key: | QOEDTNASEBLOIF-UHFFFAOYSA-N |