AP-964/41445950
TL;DR: AP-964/41445950 (CAS 667404-53-7) is a chemical compound with molecular formula C21H18N4O and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-(2-methylphenyl)-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: AP-964/41445950, 6-amino-4-(2-methylphenyl)-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(2-methylphenyl)-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(2-methylphenyl)-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl cyanide
| Molecular Formula | C21H18N4O |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 3.91172 |
| Topological Polar Surface Area | 87.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.14807 |
| Heavy Atoms | 26 |
| Complexity | 1054.3602 |
Chemical Identifiers
| CAS Number | 667404-53-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=CC=C4C |
Product Overview
AP-964/41445950 (CAS 667404-53-7), with molecular formula C21H18N4O and molecular weight 342.15 g/mol. IUPAC: 6-amino-4-(2-methylphenyl)-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of AP-964/41445950
Property Insights of AP-964/41445950
The XLogP value of 3.91172 indicates that AP-964/41445950 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.72 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-964/41445950. Following Lipinski's Rule of Five, AP-964/41445950 has 2 hydrogen bond donor(s) and 4 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 AP-964/41445950?
The CAS number of AP-964/41445950 is 667404-53-7.
What is the molecular formula of AP-964/41445950?
The molecular formula of AP-964/41445950 is C21H18N4O.
What is the molecular weight of AP-964/41445950?
The molecular weight of AP-964/41445950 is 342.15 g/mol.
Where can I buy AP-964/41445950?
You can request a quote for AP-964/41445950 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-964/41445950?
Yes, KEHONG BIO provides custom synthesis services for AP-964/41445950 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.