6-[(4-benzylpiperazin-1-yl)methyl]-2-(4-decanoylpiperazin-1-yl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-[(4-benzylpiperazin-1-yl)methyl]-2-(4-decanoylpiperazin-1-yl)pyrimidin-4(3H)-one
6-[(4-benzylpiperazin-1-yl)methyl]-2-(4-decanoylpiperazin-1-yl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-6335 |
| Compound Name: | 6-[(4-benzylpiperazin-1-yl)methyl]-2-(4-decanoylpiperazin-1-yl)pyrimidin-4(3H)-one |
| Molecular Weight: | 522.74 |
| Molecular Formula: | C30 H46 N6 O2 |
| Salt: | not_available |
| Smiles: | CCCCCCCCCC(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)Cc2ccccc2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1763 |
| logD: | 2.3889 |
| logSw: | -4.0518 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.836 |
| InChI Key: | IIRHAWZDNBALRL-UHFFFAOYSA-N |