2-(4-hexanoyl-1,4-diazepan-1-yl)-6-[(4-phenylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-hexanoyl-1,4-diazepan-1-yl)-6-[(4-phenylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
2-(4-hexanoyl-1,4-diazepan-1-yl)-6-[(4-phenylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V020-5940 |
| Compound Name: | 2-(4-hexanoyl-1,4-diazepan-1-yl)-6-[(4-phenylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 466.63 |
| Molecular Formula: | C26 H38 N6 O2 |
| Smiles: | CCCCCC(N1CCCN(CC1)C1NC(C=C(CN2CCN(CC2)c2ccccc2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7798 |
| logD: | 1.2783 |
| logSw: | -3.174 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.887 |
| InChI Key: | FUZPOHTXNJUQTG-UHFFFAOYSA-N |