1-(2,3-dihydro-1H-indol-1-yl)-2-({4-ethyl-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-({4-ethyl-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-({4-ethyl-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one
Compound characteristics
Compound ID: | L850-0282 |
Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-({4-ethyl-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethan-1-one |
Molecular Weight: | 446.53 |
Molecular Formula: | C23 H22 N6 O2 S |
Smiles: | CCn1c(c2nc(c3cccc(C)c3)no2)nnc1SCC(N1CCc2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 4.5714 |
logD: | 4.5714 |
logSw: | -4.3488 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 71.066 |
InChI Key: | GSNDSYKVYWUEEJ-UHFFFAOYSA-N |