5-[(2-chloro-6-fluorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-methyl-2-(2-methylpropyl)pyrimidine
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-methyl-2-(2-methylpropyl)pyrimidine
5-[(2-chloro-6-fluorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-methyl-2-(2-methylpropyl)pyrimidine
Compound characteristics
| Compound ID: | V005-2688 |
| Compound Name: | 5-[(2-chloro-6-fluorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-methyl-2-(2-methylpropyl)pyrimidine |
| Molecular Weight: | 469.02 |
| Molecular Formula: | C22 H30 Cl F N4 O2 S |
| Salt: | not_available |
| Smiles: | CCS(N1CCN(CC1)c1c(Cc2c(cccc2[Cl])F)c(C)nc(CC(C)C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1069 |
| logD: | 5.0478 |
| logSw: | -5.5865 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.176 |
| InChI Key: | VBXVQDGUGCHBQX-UHFFFAOYSA-N |