5-[(2-chloro-6-fluorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-phenylpyrimidine
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-phenylpyrimidine
5-[(2-chloro-6-fluorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-phenylpyrimidine
Compound characteristics
| Compound ID: | V011-3316 |
| Compound Name: | 5-[(2-chloro-6-fluorophenyl)methyl]-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-phenylpyrimidine |
| Molecular Weight: | 519.04 |
| Molecular Formula: | C25 H28 Cl F N4 O3 S |
| Salt: | not_available |
| Smiles: | CCS(N1CCN(CC1)c1c(Cc2c(cccc2[Cl])F)c(COC)nc(c2ccccc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5174 |
| logD: | 5.5009 |
| logSw: | -5.99 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.026 |
| InChI Key: | XTVBXGASRONGPS-UHFFFAOYSA-N |