1-(3,4-dimethylphenyl)-N-[(thiophen-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-(3,4-dimethylphenyl)-N-[(thiophen-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
1-(3,4-dimethylphenyl)-N-[(thiophen-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | L524-0530 |
Compound Name: | 1-(3,4-dimethylphenyl)-N-[(thiophen-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 312.39 |
Molecular Formula: | C16 H16 N4 O S |
Smiles: | Cc1ccc(cc1C)n1cc(C(NCc2cccs2)=O)nn1 |
Stereo: | ACHIRAL |
logP: | 3.5895 |
logD: | 3.5895 |
logSw: | -3.682 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.035 |
InChI Key: | AKXKQBRZZZVWJL-UHFFFAOYSA-N |