(e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione
TL;DR: (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione (CAS 1173698-60-6) is a chemical compound with molecular formula C12H8FN3O4 and molecular weight 277.0499 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[(E)-2-(2-fluorophenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione
Also Known As: BAS 08192961, (e)-6-(2-fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione, 6-[(E)-2-(2-fluorophenyl)ethenyl]-5-nitropyrimidine-2,4-diol, 6-[(E)-2-(2-fluorophenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione
Technical Specifications
| Molecular Formula | C12H8FN3O4 |
| Molecular Weight | 277.0499 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.0499 Da |
| Heavy Atoms | 20 |
| Complexity | 509.0 |
| SMILES | C1=CC=C(C(=C1)/C=C/C2=C(C(=O)NC(=O)N2)[N+](=O)[O-])F |
| InChIKey | WTMMNABBVHOZLT-AATRIKPKSA-N |
Chemical Property Profile of (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione
Property Insights of (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione. Following Lipinski's Rule of Five, (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione?
The CAS number of (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione is 1173698-60-6.
What is the molecular formula of (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione?
The molecular formula of (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione is C12H8FN3O4.
What is the molecular weight of (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione?
The molecular weight of (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione is 277.0499 g/mol.
Where can I buy (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione?
You can request a quote for (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione?
Yes, CoreyChem provides custom synthesis services for (e)-6-(2-Fluorostyryl)-5-nitropyrimidine-2,4(1h,3h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.