N-[(4-chlorophenyl)methyl]-2-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide
N-[(4-chlorophenyl)methyl]-2-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Compound characteristics
Compound ID: | C527-0578 |
Compound Name: | N-[(4-chlorophenyl)methyl]-2-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide |
Molecular Weight: | 416.93 |
Molecular Formula: | C21 H21 Cl N2 O3 S |
Smiles: | Cc1cccc(c1)c1nc(CS(CC(NCc2ccc(cc2)[Cl])=O)=O)c(C)o1 |
Stereo: | ACHIRAL |
logP: | 3.6123 |
logD: | 3.6123 |
logSw: | -4.0102 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.604 |
InChI Key: | YJVUKFLEMMTIGP-UHFFFAOYSA-N |