ethyl 4-(3,4-dichlorophenyl)-2-oxo-6-({4-[(propan-2-yl)carbamoyl]piperazin-1-yl}methyl)-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(3,4-dichlorophenyl)-2-oxo-6-({4-[(propan-2-yl)carbamoyl]piperazin-1-yl}methyl)-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(3,4-dichlorophenyl)-2-oxo-6-({4-[(propan-2-yl)carbamoyl]piperazin-1-yl}methyl)-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V008-9454 |
| Compound Name: | ethyl 4-(3,4-dichlorophenyl)-2-oxo-6-({4-[(propan-2-yl)carbamoyl]piperazin-1-yl}methyl)-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 538.47 |
| Molecular Formula: | C25 H33 Cl2 N5 O4 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccc(c(c2)[Cl])[Cl])NC(N(CC=C)C=1CN1CCN(CC1)C(NC(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1291 |
| logD: | 2.1853 |
| logSw: | -4.4795 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.58 |
| InChI Key: | VCAHVOMWTPPSKD-QFIPXVFZSA-N |