AP-964/41446546
TL;DR: AP-964/41446546 (CAS 667404-67-3) is a chemical compound with molecular formula C28H23ClN4O3 and molecular weight 498.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-[3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl]-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: AP-964/41446546, 6-amino-4-[3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl]-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-{3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl}-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-AMINO-4-{3-[(2-CHLOROPHENOXY)METHYL]-4-METHOXYPHENYL}-3-(4-METHYLPHENYL)-1,4-DIHYDROPYRANO[2,3-C]PYRAZOL-5-YL CYANIDE
| Molecular Formula | C28H23ClN4O3 |
|---|---|
| Molecular Weight | 498.15 g/mol |
| LogP | 5.8443 |
| Topological Polar Surface Area | 106.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 498.14587 |
| Heavy Atoms | 36 |
| Complexity | 1502.2163 |
Chemical Identifiers
| CAS Number | 667404-67-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=C(C=C4)OC)COC5=CC=CC=C5Cl |
Product Overview
AP-964/41446546 (CAS 667404-67-3), with molecular formula C28H23ClN4O3 and molecular weight 498.15 g/mol. IUPAC: 6-amino-4-[3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl]-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of AP-964/41446546
Property Insights of AP-964/41446546
The XLogP value of 5.8443 indicates that AP-964/41446546 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.18 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-964/41446546. Following Lipinski's Rule of Five, AP-964/41446546 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AP-964/41446546?
The CAS number of AP-964/41446546 is 667404-67-3.
What is the molecular formula of AP-964/41446546?
The molecular formula of AP-964/41446546 is C28H23ClN4O3.
What is the molecular weight of AP-964/41446546?
The molecular weight of AP-964/41446546 is 498.15 g/mol.
Where can I buy AP-964/41446546?
You can request a quote for AP-964/41446546 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-964/41446546?
Yes, KEHONG BIO provides custom synthesis services for AP-964/41446546 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.