3-butyl-5-fluoro-1-[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-butyl-5-fluoro-1-[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
3-butyl-5-fluoro-1-[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 6413-0269 |
| Compound Name: | 3-butyl-5-fluoro-1-[(4-methoxy-3-nitrophenyl)methyl]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 351.33 |
| Molecular Formula: | C16 H18 F N3 O5 |
| Smiles: | CCCCN1C(C(=CN(Cc2ccc(c(c2)[N+]([O-])=O)OC)C1=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1154 |
| logD: | 2.1154 |
| logSw: | -2.6896 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.358 |
| InChI Key: | BFBOGOOLMPHJJH-UHFFFAOYSA-N |