2-{[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethan-1-one
2-{[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethan-1-one
Compound characteristics
Compound ID: | 8013-5516 |
Compound Name: | 2-{[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethan-1-one |
Molecular Weight: | 324.36 |
Molecular Formula: | C16 H12 N4 O2 S |
Smiles: | C(C(c1c[nH]c2ccccc12)=O)Sc1nnc(c2ccco2)[nH]1 |
Stereo: | ACHIRAL |
logP: | 2.4628 |
logD: | 0.9085 |
logSw: | -2.9201 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.17 |
InChI Key: | AGGRXXUFSFJSSA-UHFFFAOYSA-N |