1-(4-{2-(butan-2-yl)-5-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)-2-methoxyethan-1-one
Chemical Structure Depiction of
1-(4-{2-(butan-2-yl)-5-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)-2-methoxyethan-1-one
1-(4-{2-(butan-2-yl)-5-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)-2-methoxyethan-1-one
Compound characteristics
| Compound ID: | V030-7185 |
| Compound Name: | 1-(4-{2-(butan-2-yl)-5-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)-2-methoxyethan-1-one |
| Molecular Weight: | 448.97 |
| Molecular Formula: | C23 H30 Cl F N4 O2 |
| Salt: | not_available |
| Smiles: | CCC(C)c1nc(C)c(Cc2c(cccc2[Cl])F)c(n1)N1CCN(CC1)C(COC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4528 |
| logD: | 4.3951 |
| logSw: | -4.4969 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.125 |
| InChI Key: | GSTSEJASZYDEAI-HNNXBMFYSA-N |