2-(butan-2-yl)-4-[4-(ethanesulfonyl)piperazin-1-yl]-5-[(2-fluorophenyl)methyl]-6-methylpyrimidine
Chemical Structure Depiction of
2-(butan-2-yl)-4-[4-(ethanesulfonyl)piperazin-1-yl]-5-[(2-fluorophenyl)methyl]-6-methylpyrimidine
2-(butan-2-yl)-4-[4-(ethanesulfonyl)piperazin-1-yl]-5-[(2-fluorophenyl)methyl]-6-methylpyrimidine
Compound characteristics
| Compound ID: | V028-0399 |
| Compound Name: | 2-(butan-2-yl)-4-[4-(ethanesulfonyl)piperazin-1-yl]-5-[(2-fluorophenyl)methyl]-6-methylpyrimidine |
| Molecular Weight: | 434.58 |
| Molecular Formula: | C22 H31 F N4 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)c1nc(C)c(Cc2ccccc2F)c(n1)N1CCN(CC1)S(CC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7543 |
| logD: | 4.6966 |
| logSw: | -4.5218 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.185 |
| InChI Key: | XYMIPLPFKOTMBQ-INIZCTEOSA-N |