{4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
{4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V004-6476 |
| Compound Name: | {4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-(methoxymethyl)pyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 550.7 |
| Molecular Formula: | C29 H35 F N6 O2 S |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)C(c1ccc(CSc2nc(COC)cc(n2)N2CCN(CC2)c2ccccc2F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8597 |
| logD: | 3.729 |
| logSw: | -4.0147 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.18 |
| InChI Key: | POLXVFVHFBVXBM-UHFFFAOYSA-N |