N-(2-chlorophenyl)-2-[(4-ethyl-5-{[(methanesulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2-[(4-ethyl-5-{[(methanesulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(2-chlorophenyl)-2-[(4-ethyl-5-{[(methanesulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | D583-2373 |
Compound Name: | N-(2-chlorophenyl)-2-[(4-ethyl-5-{[(methanesulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
Molecular Weight: | 480.01 |
Molecular Formula: | C20 H22 Cl N5 O3 S2 |
Smiles: | CCn1c(CN(c2ccccc2)S(C)(=O)=O)nnc1SCC(Nc1ccccc1[Cl])=O |
Stereo: | ACHIRAL |
logP: | 2.4954 |
logD: | 2.4953 |
logSw: | -3.0802 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.983 |
InChI Key: | UXNZIYQCPVLMSD-UHFFFAOYSA-N |