AB00681434-01
TL;DR: AB00681434-01 (CAS 899985-49-0) is a chemical compound with molecular formula C22H19ClN4O2 and molecular weight 406.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(4-ethoxyphenyl)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide
Also Known As: AB00681434-01, 4-chloro-N-(4-ethoxyphenyl)-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carboxamide, F2759-0115, 4-chloro-N-(4-ethoxyphenyl)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide
| Molecular Formula | C22H19ClN4O2 |
|---|---|
| Molecular Weight | 406.12 g/mol |
| LogP | 5.03332 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.11966 |
| Heavy Atoms | 29 |
| Complexity | 1171.1194 |
Chemical Identifiers
| CAS Number | 899985-49-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)C2=CN=C3C(=C2Cl)C(=NN3C4=CC=CC=C4)C |
Product Overview
AB00681434-01 (CAS 899985-49-0), with molecular formula C22H19ClN4O2 and molecular weight 406.12 g/mol. IUPAC: 4-chloro-N-(4-ethoxyphenyl)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide.
Chemical Property Profile of AB00681434-01
Property Insights of AB00681434-01
The XLogP value of 5.03332 indicates that AB00681434-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00681434-01. Following Lipinski's Rule of Five, AB00681434-01 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00681434-01?
The CAS number of AB00681434-01 is 899985-49-0.
What is the molecular formula of AB00681434-01?
The molecular formula of AB00681434-01 is C22H19ClN4O2.
What is the molecular weight of AB00681434-01?
The molecular weight of AB00681434-01 is 406.12 g/mol.
Where can I buy AB00681434-01?
You can request a quote for AB00681434-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00681434-01?
Yes, KEHONG BIO provides custom synthesis services for AB00681434-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.