ethyl 6-[(4-acetylphenoxy)methyl]-1-ethyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-acetylphenoxy)methyl]-1-ethyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-acetylphenoxy)methyl]-1-ethyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V008-2686 |
| Compound Name: | ethyl 6-[(4-acetylphenoxy)methyl]-1-ethyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 467.48 |
| Molecular Formula: | C24 H25 N3 O7 |
| Smiles: | CCN1C(COc2ccc(cc2)C(C)=O)=C(C(c2cccc(c2)[N+]([O-])=O)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4256 |
| logD: | 3.3923 |
| logSw: | -3.618 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.185 |
| InChI Key: | XYHFZEKKGIQFTI-QFIPXVFZSA-N |