N-benzyl-N-methyl-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-benzyl-N-methyl-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-benzyl-N-methyl-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
Compound ID: | G637-0452 |
Compound Name: | N-benzyl-N-methyl-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
Molecular Weight: | 493.62 |
Molecular Formula: | C27 H31 N3 O4 S |
Smiles: | Cc1ccc(/C=C/c2c(c(C)no2)S(N2CCC(CC2)C(N(C)Cc2ccccc2)=O)(=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.4305 |
logD: | 4.4305 |
logSw: | -4.2608 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 69.615 |
InChI Key: | LNHPRNDWXDQLEH-UHFFFAOYSA-N |