[5-(benzylamino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[5-(benzylamino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](thiophen-2-yl)methanone
[5-(benzylamino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](thiophen-2-yl)methanone
Compound characteristics
Compound ID: | D116-0058 |
Compound Name: | [5-(benzylamino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](thiophen-2-yl)methanone |
Molecular Weight: | 350.4 |
Molecular Formula: | C18 H14 N4 O2 S |
Smiles: | C(c1ccccc1)Nc1nc(c2ccco2)nn1C(c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 3.3249 |
logD: | 3.3249 |
logSw: | -3.4855 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.824 |
InChI Key: | COQKSJDMZURBPH-UHFFFAOYSA-N |