ethyl 6-[(4-benzylpiperazin-1-yl)methyl]-4-(2,4-dichlorophenyl)-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-benzylpiperazin-1-yl)methyl]-4-(2,4-dichlorophenyl)-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-benzylpiperazin-1-yl)methyl]-4-(2,4-dichlorophenyl)-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V020-1610 |
| Compound Name: | ethyl 6-[(4-benzylpiperazin-1-yl)methyl]-4-(2,4-dichlorophenyl)-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 543.49 |
| Molecular Formula: | C28 H32 Cl2 N4 O3 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccc(cc2[Cl])[Cl])NC(N(CC=C)C=1CN1CCN(CC1)Cc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0345 |
| logD: | 3.7051 |
| logSw: | -5.173 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.276 |
| InChI Key: | YPUFUDGCYFJITO-SANMLTNESA-N |