1-{4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-1-phenyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-1-phenyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
1-{4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-1-phenyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
Compound characteristics
| Compound ID: | 6623-0992 |
| Compound Name: | 1-{4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-1-phenyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C23 H23 F N4 O S |
| Smiles: | CC1=C(C(=NC(N1c1ccccc1)=S)N1CCN(CC1)c1ccc(cc1)F)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1757 |
| logD: | 3.1683 |
| logSw: | -3.1794 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 29.9539 |
| InChI Key: | ZGZUHOQNEWPZGG-UHFFFAOYSA-N |