(4-{6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)(4-pentylphenyl)methanone
Chemical Structure Depiction of
(4-{6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)(4-pentylphenyl)methanone
(4-{6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)(4-pentylphenyl)methanone
Compound characteristics
| Compound ID: | V005-0281 |
| Compound Name: | (4-{6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)(4-pentylphenyl)methanone |
| Molecular Weight: | 532.73 |
| Molecular Formula: | C35 H40 N4 O |
| Salt: | not_available |
| Smiles: | CCCCCc1ccc(cc1)C(N1CCN(CC1)c1c(Cc2cccc(C)c2)c(C)nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 9.4369 |
| logD: | 9.3618 |
| logSw: | -5.5803 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.685 |
| InChI Key: | XTJKGURVLDRZRO-UHFFFAOYSA-N |