N-(cyanomethyl)-2-[(4-methylphenyl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(cyanomethyl)-2-[(4-methylphenyl)sulfanyl]acetamide
N-(cyanomethyl)-2-[(4-methylphenyl)sulfanyl]acetamide
Compound characteristics
Compound ID: | Y030-9336 |
Compound Name: | N-(cyanomethyl)-2-[(4-methylphenyl)sulfanyl]acetamide |
Molecular Weight: | 220.29 |
Molecular Formula: | C11 H12 N2 O S |
Smiles: | Cc1ccc(cc1)SCC(NCC#N)=O |
Stereo: | ACHIRAL |
logP: | 1.8857 |
logD: | 1.8857 |
logSw: | -2.4179 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.043 |
InChI Key: | MRRFWLAPBXYGPK-UHFFFAOYSA-N |