1-(4-chlorophenyl)-N-(2-hydroxyethyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-(4-chlorophenyl)-N-(2-hydroxyethyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
1-(4-chlorophenyl)-N-(2-hydroxyethyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | D731-0047 |
Compound Name: | 1-(4-chlorophenyl)-N-(2-hydroxyethyl)-5-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 308.77 |
Molecular Formula: | C14 H17 Cl N4 O2 |
Smiles: | CC(C)c1c(C(NCCO)=O)nnn1c1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 2.1842 |
logD: | 2.1842 |
logSw: | -2.8787 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 67.293 |
InChI Key: | PMVYDVXBIXOTFK-UHFFFAOYSA-N |