[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-methoxyphenyl)methanone
Chemical Structure Depiction of
[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-methoxyphenyl)methanone
[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-methoxyphenyl)methanone
Compound characteristics
Compound ID: | 6529-0275 |
Compound Name: | [5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-methoxyphenyl)methanone |
Molecular Weight: | 391.45 |
Molecular Formula: | C21 H17 N3 O3 S |
Smiles: | COc1ccccc1C(n1c(nc(c2ccco2)n1)SCc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.8998 |
logD: | 3.8998 |
logSw: | -4.0752 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 53.604 |
InChI Key: | SNDYNELTXFAUBH-UHFFFAOYSA-N |