ethyl 4-(2,3-dimethoxyphenyl)-1-methyl-2-oxo-6-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2,3-dimethoxyphenyl)-1-methyl-2-oxo-6-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2,3-dimethoxyphenyl)-1-methyl-2-oxo-6-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V021-5676 |
| Compound Name: | ethyl 4-(2,3-dimethoxyphenyl)-1-methyl-2-oxo-6-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 528.63 |
| Molecular Formula: | C26 H32 N4 O6 S |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2cccc(c2OC)OC)NC(N(C)C=1CN1CCN(CC1)C(c1cccs1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3236 |
| logD: | 1.8058 |
| logSw: | -2.8752 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.345 |
| InChI Key: | BGEIKKDTXUACHB-JOCHJYFZSA-N |