[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](thiophen-2-yl)methanone
[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](thiophen-2-yl)methanone
Compound characteristics
Compound ID: | 6529-0287 |
Compound Name: | [5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](thiophen-2-yl)methanone |
Molecular Weight: | 367.45 |
Molecular Formula: | C18 H13 N3 O2 S2 |
Smiles: | C(c1ccccc1)Sc1nc(c2ccco2)nn1C(c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 4.0462 |
logD: | 4.0462 |
logSw: | -4.2348 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 46.992 |
InChI Key: | MXRHYHHUIYFVKZ-UHFFFAOYSA-N |