AF-399/14605016
TL;DR: AF-399/14605016 (CAS 342779-87-7) is a chemical compound with molecular formula C18H13ClN4O2 and molecular weight 352.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-[5-(2-chlorophenyl)furan-2-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: AF-399/14605016, 6-amino-4-(5-(2-chlorophenyl)-2-furyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(5-(2-chlorophenyl)furan-2-yl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-[5-(2-chlorophenyl)(2-furyl)]-3-methyl-4H-pyrano[2,3-c]pyrazole-5-ca rbonitrile, 6-amino-4-[5-(2-chlorophenyl)-2-furyl]-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C18H13ClN4O2 |
|---|---|
| Molecular Weight | 352.07 g/mol |
| LogP | 3.8497 |
| Topological Polar Surface Area | 100.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.0727 |
| Heavy Atoms | 25 |
| Complexity | 1041.526 |
Chemical Identifiers
| CAS Number | 342779-87-7 |
|---|---|
| SMILES | CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC=C(O3)C4=CC=CC=C4Cl |
Product Overview
AF-399/14605016 (CAS 342779-87-7), with molecular formula C18H13ClN4O2 and molecular weight 352.07 g/mol. IUPAC: 6-amino-4-[5-(2-chlorophenyl)furan-2-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of AF-399/14605016
Property Insights of AF-399/14605016
The XLogP value of 3.8497 indicates that AF-399/14605016 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.86 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/14605016. Following Lipinski's Rule of Five, AF-399/14605016 has 2 hydrogen bond donor(s) and 5 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 AF-399/14605016?
The CAS number of AF-399/14605016 is 342779-87-7.
What is the molecular formula of AF-399/14605016?
The molecular formula of AF-399/14605016 is C18H13ClN4O2.
What is the molecular weight of AF-399/14605016?
The molecular weight of AF-399/14605016 is 352.07 g/mol.
Where can I buy AF-399/14605016?
You can request a quote for AF-399/14605016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/14605016?
Yes, KEHONG BIO provides custom synthesis services for AF-399/14605016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.