ethyl 1-ethyl-2-oxo-4-[4-(propan-2-yl)phenyl]-6-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-2-oxo-4-[4-(propan-2-yl)phenyl]-6-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-ethyl-2-oxo-4-[4-(propan-2-yl)phenyl]-6-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V019-9104 |
| Compound Name: | ethyl 1-ethyl-2-oxo-4-[4-(propan-2-yl)phenyl]-6-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 524.68 |
| Molecular Formula: | C28 H36 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCN1C(CN2CCN(CC2)C(c2cccs2)=O)=C(C(c2ccc(cc2)C(C)C)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.273 |
| logD: | 3.8399 |
| logSw: | -3.8882 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.956 |
| InChI Key: | YZYUXTPDNMOCNA-RUZDIDTESA-N |