pentyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
pentyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
pentyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 1630-0771 |
| Compound Name: | pentyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C17 H21 N3 O5 |
| Smiles: | CCCCCOC(C1C(c2cccc(c2)[N+]([O-])=O)NC(NC=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0511 |
| logD: | 2.9009 |
| logSw: | -3.2172 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.121 |
| InChI Key: | WKLFIWHVVOEIES-HNNXBMFYSA-N |