1-{1-benzyl-4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
Chemical Structure Depiction of
1-{1-benzyl-4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
1-{1-benzyl-4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one
Compound characteristics
| Compound ID: | 6623-1047 |
| Compound Name: | 1-{1-benzyl-4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-2-sulfanylidene-1,2-dihydropyrimidin-5-yl}ethan-1-one |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C24 H25 F N4 O S |
| Smiles: | CC1=C(C(=NC(N1Cc1ccccc1)=S)N1CCN(CC1)c1ccc(cc1)F)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7729 |
| logD: | 3.7729 |
| logSw: | -3.8641 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.5654 |
| InChI Key: | QJGFLFQWZLGHSD-UHFFFAOYSA-N |