1-(2,4-dichlorophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
1-(2,4-dichlorophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
1-(2,4-dichlorophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
Compound ID: | D155-0011 |
Compound Name: | 1-(2,4-dichlorophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-en-1-one |
Molecular Weight: | 309.19 |
Molecular Formula: | C15 H14 Cl2 N2 O |
Smiles: | Cc1c(/C=C/C(c2ccc(cc2[Cl])[Cl])=O)c(C)n(C)n1 |
Stereo: | ACHIRAL |
logP: | 3.2206 |
logD: | 3.2206 |
logSw: | -3.7252 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 28.0532 |
InChI Key: | ZTGHPXIQAQTMOD-UHFFFAOYSA-N |