2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Chemical Structure Depiction of
2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Compound characteristics
Compound ID: | Y031-2621 |
Compound Name: | 2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide |
Molecular Weight: | 331.22 |
Molecular Formula: | C13 H12 Cl2 N2 O2 S |
Smiles: | Cc1cc(NC(CSCc2ccc(c(c2)[Cl])[Cl])=O)no1 |
Stereo: | ACHIRAL |
logP: | 4.5896 |
logD: | 4.4391 |
logSw: | -4.6297 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.912 |
InChI Key: | KOWDHXINVCLMIO-UHFFFAOYSA-N |