1-(1-methyl-1H-pyrazol-4-yl)-3-(3-methylthiophen-2-yl)prop-2-en-1-one
Chemical Structure Depiction of
1-(1-methyl-1H-pyrazol-4-yl)-3-(3-methylthiophen-2-yl)prop-2-en-1-one
1-(1-methyl-1H-pyrazol-4-yl)-3-(3-methylthiophen-2-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-6502 |
| Compound Name: | 1-(1-methyl-1H-pyrazol-4-yl)-3-(3-methylthiophen-2-yl)prop-2-en-1-one |
| Molecular Weight: | 232.3 |
| Molecular Formula: | C12 H12 N2 O S |
| Smiles: | Cc1ccsc1/C=C/C(c1cnn(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0297 |
| logD: | 2.0297 |
| logSw: | -2.1872 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.0411 |
| InChI Key: | CPTBBOQFRUUSPF-UHFFFAOYSA-N |