F3220-0554
TL;DR: F3220-0554 (CAS 392737-45-0) is a chemical compound with molecular formula C12H10N4O5S and molecular weight 322.0372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-hydroxy-5-[(2-methoxy-4-nitrophenyl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: F3220-0554, 5-{[(2-METHOXY-4-NITROPHENYL)AMINO]METHYLIDENE}-2-SULFANYLIDENE-1,3-DIAZINANE-4,6-DIONE, 5-(((2-methoxy-4-nitrophenyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 5-[(2-methoxy-4-nitroanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[[(2-methoxy-4-nitro-phenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Technical Specifications
| Molecular Formula | C12H10N4O5S |
| Molecular Weight | 322.0372 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.0372 Da |
| Heavy Atoms | 22 |
| Complexity | 556.0 |
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])N=CC2=C(NC(=S)NC2=O)O |
| InChIKey | PNVMXOPKOZYCJD-UHFFFAOYSA-N |
Chemical Property Profile of F3220-0554
Property Insights of F3220-0554
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F3220-0554. The TPSA of 161.0 Ų indicates high polarity, suggesting F3220-0554 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F3220-0554 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of F3220-0554?
The CAS number of F3220-0554 is 392737-45-0.
What is the molecular formula of F3220-0554?
The molecular formula of F3220-0554 is C12H10N4O5S.
What is the molecular weight of F3220-0554?
The molecular weight of F3220-0554 is 322.0372 g/mol.
Where can I buy F3220-0554?
You can request a quote for F3220-0554 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F3220-0554?
Yes, CoreyChem provides custom synthesis services for F3220-0554 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.