A3759/0159416
TL;DR: A3759/0159416 (CAS 727670-46-4) is a chemical compound with molecular formula C15H16N4O5 and molecular weight 332.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-ethyl-2'-methyl-6'-nitrospiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione
Also Known As: A3759/0159416, 1'-ethyl-2'-methyl-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione, 1'-ethyl-2'-methyl-6'-nitrospiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione, 1'-ethyl-2'-methyl-6'-nitro-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione, 1-ethyl-2-methyl-6-nitrospiro[1',2',3,4'-tetrahydroquinoline-3,5'-1,3,5-trihyd ropyrimidine]-12,14,16-trione
| Molecular Formula | C15H16N4O5 |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | 0.7181 |
| Topological Polar Surface Area | 121.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.11206 |
| Heavy Atoms | 24 |
| Complexity | 755.1279 |
Chemical Identifiers
| CAS Number | 727670-46-4 |
|---|---|
| SMILES | CCN1C(C2(CC3=C1C=CC(=C3)[N+](=O)[O-])C(=O)NC(=O)NC2=O)C |
Product Overview
A3759/0159416 (CAS 727670-46-4), with molecular formula C15H16N4O5 and molecular weight 332.11 g/mol. IUPAC: 1'-ethyl-2'-methyl-6'-nitrospiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione.
Chemical Property Profile of A3759/0159416
Property Insights of A3759/0159416
The XLogP value of 0.7181 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3759/0159416. The TPSA of 121.65 Ų falls within the moderate polarity range, balancing permeability and solubility for A3759/0159416. Following Lipinski's Rule of Five, A3759/0159416 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 A3759/0159416?
The CAS number of A3759/0159416 is 727670-46-4.
What is the molecular formula of A3759/0159416?
The molecular formula of A3759/0159416 is C15H16N4O5.
What is the molecular weight of A3759/0159416?
The molecular weight of A3759/0159416 is 332.11 g/mol.
Where can I buy A3759/0159416?
You can request a quote for A3759/0159416 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3759/0159416?
Yes, KEHONG BIO provides custom synthesis services for A3759/0159416 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.