6-{[benzyl(ethyl)amino]methyl}-2-[4-(2-bromobenzoyl)piperazin-1-yl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[benzyl(ethyl)amino]methyl}-2-[4-(2-bromobenzoyl)piperazin-1-yl]pyrimidin-4(3H)-one
6-{[benzyl(ethyl)amino]methyl}-2-[4-(2-bromobenzoyl)piperazin-1-yl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-6737 |
| Compound Name: | 6-{[benzyl(ethyl)amino]methyl}-2-[4-(2-bromobenzoyl)piperazin-1-yl]pyrimidin-4(3H)-one |
| Molecular Weight: | 510.43 |
| Molecular Formula: | C25 H28 Br N5 O2 |
| Salt: | not_available |
| Smiles: | CCN(CC1=CC(NC(=N1)N1CCN(CC1)C(c1ccccc1[Br])=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.873 |
| logD: | 0.2031 |
| logSw: | -3.5299 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.255 |
| InChI Key: | OBWLLZWYWNBXOE-UHFFFAOYSA-N |