N-(4-carbamoylphenyl)-3-{1-[(4-methylphenyl)methyl]-1H-1,2,3-triazol-4-yl}-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-(4-carbamoylphenyl)-3-{1-[(4-methylphenyl)methyl]-1H-1,2,3-triazol-4-yl}-1,2,4-oxadiazole-5-carboxamide
N-(4-carbamoylphenyl)-3-{1-[(4-methylphenyl)methyl]-1H-1,2,3-triazol-4-yl}-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
Compound ID: | P508-1141 |
Compound Name: | N-(4-carbamoylphenyl)-3-{1-[(4-methylphenyl)methyl]-1H-1,2,3-triazol-4-yl}-1,2,4-oxadiazole-5-carboxamide |
Molecular Weight: | 403.4 |
Molecular Formula: | C20 H17 N7 O3 |
Smiles: | Cc1ccc(Cn2cc(c3nc(C(Nc4ccc(cc4)C(N)=O)=O)on3)nn2)cc1 |
Stereo: | ACHIRAL |
logP: | 1.8789 |
logD: | 1.8696 |
logSw: | -2.5499 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 115.579 |
InChI Key: | QFTQGSRDNKLUPB-UHFFFAOYSA-N |