A4022/0171558
TL;DR: A4022/0171558 (CAS 879616-07-6) is a chemical compound with molecular formula C17H15FN6O and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-6-(4-fluoroanilino)-1'-methylspiro[1H-1,3,5-triazine-4,3'-indole]-2'-one
Also Known As: A4022/0171558, 4'-amino-6'-[(4-fluorophenyl)amino]-1-methyl-5'H-spiro[indole-3,2'-[1,3,5]triazin]-2(1H)-one, 2-amino-6-(4-fluoroanilino)-1'-methylspiro[1H-1,3,5-triazine-4,3'-indole]-2'-one, 4'-amino-6'-((4-fluorophenyl)amino)-1-methyl-5'H-spiro[indoline-3,2'-[1,3,5]triazin]-2-one, 6'-AMINO-4'-[(4-FLUOROPHENYL)AMINO]-1-METHYL-1,2-DIHYDRO-5'H-SPIRO[INDOLE-3,2'-[1,3,5]TRIAZIN]-2-ONE
| Molecular Formula | C17H15FN6O |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 1.3409 |
| Topological Polar Surface Area | 95.11 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 338.12915 |
| Heavy Atoms | 25 |
| Complexity | 922.99023 |
Chemical Identifiers
| CAS Number | 879616-07-6 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C3(C1=O)N=C(NC(=N3)NC4=CC=C(C=C4)F)N |
Product Overview
A4022/0171558 (CAS 879616-07-6), with molecular formula C17H15FN6O and molecular weight 338.13 g/mol. IUPAC: 2-amino-6-(4-fluoroanilino)-1'-methylspiro[1H-1,3,5-triazine-4,3'-indole]-2'-one.
Chemical Property Profile of A4022/0171558
Property Insights of A4022/0171558
The XLogP value of 1.3409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A4022/0171558. The TPSA of 95.11 Ų falls within the moderate polarity range, balancing permeability and solubility for A4022/0171558. Following Lipinski's Rule of Five, A4022/0171558 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 A4022/0171558?
The CAS number of A4022/0171558 is 879616-07-6.
What is the molecular formula of A4022/0171558?
The molecular formula of A4022/0171558 is C17H15FN6O.
What is the molecular weight of A4022/0171558?
The molecular weight of A4022/0171558 is 338.13 g/mol.
Where can I buy A4022/0171558?
You can request a quote for A4022/0171558 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4022/0171558?
Yes, KEHONG BIO provides custom synthesis services for A4022/0171558 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.