N-(3,4-difluorophenyl)-2-[(4-ethyl-5-{[(4-fluorophenyl)(methanesulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3,4-difluorophenyl)-2-[(4-ethyl-5-{[(4-fluorophenyl)(methanesulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(3,4-difluorophenyl)-2-[(4-ethyl-5-{[(4-fluorophenyl)(methanesulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | D532-0375 |
Compound Name: | N-(3,4-difluorophenyl)-2-[(4-ethyl-5-{[(4-fluorophenyl)(methanesulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
Molecular Weight: | 499.53 |
Molecular Formula: | C20 H20 F3 N5 O3 S2 |
Smiles: | CCn1c(CN(c2ccc(cc2)F)S(C)(=O)=O)nnc1SCC(Nc1ccc(c(c1)F)F)=O |
Stereo: | ACHIRAL |
logP: | 2.9519 |
logD: | 2.9438 |
logSw: | -3.4341 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.68 |
InChI Key: | RVIJZDXXSNGPAH-UHFFFAOYSA-N |