A3686/0156389
TL;DR: A3686/0156389 (CAS 573669-35-9) is a chemical compound with molecular formula C20H15ClN6O and molecular weight 390.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-benzyl-4-[(4-chlorophenoxy)methyl]-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
Also Known As: A3686/0156389, 7-benzyl-2-((4-chlorophenoxy)methyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine, 7-benzyl-2-[(4-chlorophenoxy)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine, (7-BENZYL-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-2-YL)METHYL (4-CHLOROPHENYL) ETHER
| Molecular Formula | C20H15ClN6O |
|---|---|
| Molecular Weight | 390.10 g/mol |
| LogP | 3.7547 |
| Topological Polar Surface Area | 70.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.09958 |
| Heavy Atoms | 28 |
| Complexity | 1246.6741 |
Chemical Identifiers
| CAS Number | 573669-35-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=C(C=N2)C4=NC(=NN4C=N3)COC5=CC=C(C=C5)Cl |
Product Overview
A3686/0156389 (CAS 573669-35-9), with molecular formula C20H15ClN6O and molecular weight 390.10 g/mol. IUPAC: 10-benzyl-4-[(4-chlorophenoxy)methyl]-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene.
Chemical Property Profile of A3686/0156389
Property Insights of A3686/0156389
The XLogP value of 3.7547 indicates that A3686/0156389 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.13 Ų falls within the moderate polarity range, balancing permeability and solubility for A3686/0156389. Following Lipinski's Rule of Five, A3686/0156389 has 0 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 A3686/0156389?
The CAS number of A3686/0156389 is 573669-35-9.
What is the molecular formula of A3686/0156389?
The molecular formula of A3686/0156389 is C20H15ClN6O.
What is the molecular weight of A3686/0156389?
The molecular weight of A3686/0156389 is 390.10 g/mol.
Where can I buy A3686/0156389?
You can request a quote for A3686/0156389 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3686/0156389?
Yes, KEHONG BIO provides custom synthesis services for A3686/0156389 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.