(oxolan-2-yl)methyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
(oxolan-2-yl)methyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
(oxolan-2-yl)methyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8014-7692 |
| Compound Name: | (oxolan-2-yl)methyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 421.41 |
| Molecular Formula: | C19 H23 N3 O8 |
| Smiles: | CC1=C(C(c2cc(c(c(c2)OC)O)[N+]([O-])=O)NC(N1C)=O)C(=O)OCC1CCCO1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1913 |
| logD: | 0.3782 |
| logSw: | -2.1568 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.377 |
| InChI Key: | YTYRLCRDULRQOT-UHFFFAOYSA-N |