6-{[benzyl(methyl)amino]methyl}-2-(4-pentanoylpiperazin-1-yl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[benzyl(methyl)amino]methyl}-2-(4-pentanoylpiperazin-1-yl)pyrimidin-4(3H)-one
6-{[benzyl(methyl)amino]methyl}-2-(4-pentanoylpiperazin-1-yl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V018-7536 |
| Compound Name: | 6-{[benzyl(methyl)amino]methyl}-2-(4-pentanoylpiperazin-1-yl)pyrimidin-4(3H)-one |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C22 H31 N5 O2 |
| Smiles: | CCCCC(N1CCN(CC1)C1NC(C=C(CN(C)Cc2ccccc2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0394 |
| logD: | -0.477 |
| logSw: | -2.6982 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.407 |
| InChI Key: | QQFZPIJJTRCWBI-UHFFFAOYSA-N |