1-[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
1-[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 5504-0489 |
| Compound Name: | 1-[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 277.23 |
| Molecular Formula: | C12 H11 N3 O5 |
| Smiles: | COc1ccc(CN2C=CC(NC2=O)=O)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.1549 |
| logD: | 0.1546 |
| logSw: | -2.1834 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.484 |
| InChI Key: | XSOSOSFPAWZWJP-UHFFFAOYSA-N |