(5-chloro-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidin-4-yl)[4-(4-methoxyphenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(5-chloro-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidin-4-yl)[4-(4-methoxyphenyl)piperazin-1-yl]methanone
(5-chloro-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidin-4-yl)[4-(4-methoxyphenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | D233-0229 |
| Compound Name: | (5-chloro-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidin-4-yl)[4-(4-methoxyphenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 472.97 |
| Molecular Formula: | C23 H22 Cl F N4 O2 S |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(c1c(cnc(n1)SCc1ccccc1F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9985 |
| logD: | 4.9985 |
| logSw: | -5.1335 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.005 |
| InChI Key: | MFFDDDMFDXQBAV-UHFFFAOYSA-N |