6-chloro-4-phenyl-3-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}quinolin-2(1H)-one
Chemical Structure Depiction of
6-chloro-4-phenyl-3-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}quinolin-2(1H)-one
6-chloro-4-phenyl-3-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}quinolin-2(1H)-one
Compound characteristics
Compound ID: | 5236-0308 |
Compound Name: | 6-chloro-4-phenyl-3-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}quinolin-2(1H)-one |
Molecular Weight: | 477.01 |
Molecular Formula: | C24 H17 Cl N4 O S2 |
Smiles: | C=CCn1c(c2cccs2)nnc1SC1=C(c2ccccc2)c2cc(ccc2NC1=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 6.1126 |
logD: | 6.1126 |
logSw: | -6.2159 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.844 |
InChI Key: | JWKFFNPFJUUSST-UHFFFAOYSA-N |