A3565/0151239
TL;DR: A3565/0151239 (CAS 696606-47-0) is a chemical compound with molecular formula C13H12N4O4S and molecular weight 320.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-methyl-6'-nitro-2-sulfanylidenespiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-4,6-dione
Also Known As: A3565/0151239, 1'-methyl-6'-nitro-2-sulfanylidenespiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-4,6-dione, 1'-methyl-6'-nitro-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione, 1'-methyl-6'-nitro-2-thioxo-2,2',3,4'-tetrahydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-4,6-dione, 6-hydroxy-1'-methyl-6'-nitro-2-sulfanyl-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one
| Molecular Formula | C13H12N4O4S |
|---|---|
| Molecular Weight | 320.06 g/mol |
| LogP | 0.1044 |
| Topological Polar Surface Area | 104.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.05792 |
| Heavy Atoms | 22 |
| Complexity | 712.7503 |
Chemical Identifiers
| CAS Number | 696606-47-0 |
|---|---|
| SMILES | CN1CC2(CC3=C1C=CC(=C3)[N+](=O)[O-])C(=O)NC(=S)NC2=O |
Product Overview
A3565/0151239 (CAS 696606-47-0), with molecular formula C13H12N4O4S and molecular weight 320.06 g/mol. IUPAC: 1'-methyl-6'-nitro-2-sulfanylidenespiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-4,6-dione.
Chemical Property Profile of A3565/0151239
Property Insights of A3565/0151239
The XLogP value of 0.1044 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3565/0151239. The TPSA of 104.58 Ų falls within the moderate polarity range, balancing permeability and solubility for A3565/0151239. Following Lipinski's Rule of Five, A3565/0151239 has 2 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 A3565/0151239?
The CAS number of A3565/0151239 is 696606-47-0.
What is the molecular formula of A3565/0151239?
The molecular formula of A3565/0151239 is C13H12N4O4S.
What is the molecular weight of A3565/0151239?
The molecular weight of A3565/0151239 is 320.06 g/mol.
Where can I buy A3565/0151239?
You can request a quote for A3565/0151239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3565/0151239?
Yes, KEHONG BIO provides custom synthesis services for A3565/0151239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.