F3220-0553
TL;DR: F3220-0553 (CAS 392315-95-6) is a chemical compound with molecular formula C12H10N4O4S and molecular weight 306.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-[(2-methyl-4-nitrophenyl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: F3220-0553, 5-{[(2-METHYL-4-NITROPHENYL)AMINO]METHYLIDENE}-2-SULFANYLIDENE-1,3-DIAZINANE-4,6-DIONE, 5-(((2-methyl-4-nitrophenyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 5-[(2-methyl-4-nitroanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[[(2-methyl-4-nitro-phenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C12H10N4O4S |
|---|---|
| Molecular Weight | 306.04 g/mol |
| LogP | 2.10531 |
| Topological Polar Surface Area | 124.38 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.04227 |
| Heavy Atoms | 21 |
| Complexity | 853.0664 |
Chemical Identifiers
| CAS Number | 392315-95-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])N=CC2=C(NC(=S)NC2=O)O |
Product Overview
F3220-0553 (CAS 392315-95-6), with molecular formula C12H10N4O4S and molecular weight 306.04 g/mol. IUPAC: 6-hydroxy-5-[(2-methyl-4-nitrophenyl)iminomethyl]-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of F3220-0553
Property Insights of F3220-0553
The XLogP value of 2.10531 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F3220-0553. The TPSA of 124.38 Ų falls within the moderate polarity range, balancing permeability and solubility for F3220-0553. Following Lipinski's Rule of Five, F3220-0553 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3220-0553?
The CAS number of F3220-0553 is 392315-95-6.
What is the molecular formula of F3220-0553?
The molecular formula of F3220-0553 is C12H10N4O4S.
What is the molecular weight of F3220-0553?
The molecular weight of F3220-0553 is 306.04 g/mol.
Where can I buy F3220-0553?
You can request a quote for F3220-0553 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3220-0553?
Yes, KEHONG BIO provides custom synthesis services for F3220-0553 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.