5-[(2-chloro-6-fluorophenyl)methyl]-4-methyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methyl]-4-methyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
5-[(2-chloro-6-fluorophenyl)methyl]-4-methyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine
Compound characteristics
| Compound ID: | V003-3618 |
| Compound Name: | 5-[(2-chloro-6-fluorophenyl)methyl]-4-methyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)pyrimidine |
| Molecular Weight: | 469.02 |
| Molecular Formula: | C22 H30 Cl F N4 O2 S |
| Smiles: | CCCS(N1CCN(CC1)c1c(Cc2c(cccc2[Cl])F)c(C)nc(C(C)C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0041 |
| logD: | 4.9588 |
| logSw: | -5.1663 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.185 |
| InChI Key: | WTQCRNPNVLTPPY-UHFFFAOYSA-N |