3-(2,4-dichlorophenyl)-1-[4-(4,4,6-trimethyl-2-sulfanylidene-3,4-dihydropyrimidin-1(2H)-yl)phenyl]prop-2-en-1-one
Chemical Structure Depiction of
3-(2,4-dichlorophenyl)-1-[4-(4,4,6-trimethyl-2-sulfanylidene-3,4-dihydropyrimidin-1(2H)-yl)phenyl]prop-2-en-1-one
3-(2,4-dichlorophenyl)-1-[4-(4,4,6-trimethyl-2-sulfanylidene-3,4-dihydropyrimidin-1(2H)-yl)phenyl]prop-2-en-1-one
Compound characteristics
| Compound ID: | 8004-3476 |
| Compound Name: | 3-(2,4-dichlorophenyl)-1-[4-(4,4,6-trimethyl-2-sulfanylidene-3,4-dihydropyrimidin-1(2H)-yl)phenyl]prop-2-en-1-one |
| Molecular Weight: | 431.38 |
| Molecular Formula: | C22 H20 Cl2 N2 O S |
| Smiles: | CC1=CC(C)(C)NC(N1c1ccc(cc1)C(/C=C/c1ccc(cc1[Cl])[Cl])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.0908 |
| logD: | 6.0908 |
| logSw: | -6.2202 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.8264 |
| InChI Key: | CSDFWDDSRJQBNW-UHFFFAOYSA-N |