ethyl 6-[(4-iodoanilino)methyl]-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-iodoanilino)methyl]-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-iodoanilino)methyl]-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8016-1421 |
| Compound Name: | ethyl 6-[(4-iodoanilino)methyl]-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 522.3 |
| Molecular Formula: | C20 H19 I N4 O5 |
| Smiles: | CCOC(C1C(c2cccc(c2)[N+]([O-])=O)NC(NC=1CNc1ccc(cc1)I)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2029 |
| logD: | 3.9508 |
| logSw: | -4.2357 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.668 |
| InChI Key: | JJTDUVVTVOJAQS-GOSISDBHSA-N |