ethyl 4-[(6-oxo-2-phenyl-1,6-dihydropyrimidin-4-yl)methyl]piperazine-1-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 4-[(6-oxo-2-phenyl-1,6-dihydropyrimidin-4-yl)methyl]piperazine-1-carboxylate--hydrogen chloride (1/1)
ethyl 4-[(6-oxo-2-phenyl-1,6-dihydropyrimidin-4-yl)methyl]piperazine-1-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | P198-0028 |
| Compound Name: | ethyl 4-[(6-oxo-2-phenyl-1,6-dihydropyrimidin-4-yl)methyl]piperazine-1-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 378.86 |
| Molecular Formula: | C18 H22 N4 O3 |
| Salt: | HCl |
| Smiles: | CCOC(N1CCN(CC1)CC1=CC(NC(c2ccccc2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3944 |
| logD: | 0.0911 |
| logSw: | -2.2081 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.81 |
| InChI Key: | KXHOOBKJSDANAH-UHFFFAOYSA-N |