N-[2,5-diethoxy-4-(1H-tetrazol-1-yl)phenyl]-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[2,5-diethoxy-4-(1H-tetrazol-1-yl)phenyl]-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
N-[2,5-diethoxy-4-(1H-tetrazol-1-yl)phenyl]-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | D296-0008 |
Compound Name: | N-[2,5-diethoxy-4-(1H-tetrazol-1-yl)phenyl]-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 450.46 |
Molecular Formula: | C21 H22 N8 O4 |
Smiles: | CCOc1cc(c(cc1NC(c1cn(c2ccc(cc2)OC)nn1)=O)OCC)n1cnnn1 |
Stereo: | ACHIRAL |
logP: | 2.9065 |
logD: | 2.8998 |
logSw: | -3.4887 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 110.426 |
InChI Key: | TZHCGAIQQLRROW-UHFFFAOYSA-N |