A2840/0119833
TL;DR: A2840/0119833 (CAS 442669-06-9) is a chemical compound with molecular formula C21H17ClN6O2 and molecular weight 420.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-chlorophenyl)-2,4-dimethyl-6-(pyridin-2-ylmethyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: A2840/0119833, 7-(4-chlorophenyl)-2,4-dimethyl-6-(pyridin-2-ylmethyl)purino[7,8-a]imidazole-1,3-dione, 7-(4-chlorophenyl)-1,3-dimethyl-8-(pyridin-2-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(4-CHLOROPHENYL)-1,3-DIMETHYL-8-[(PYRIDIN-2-YL)METHYL]-1H,2H,3H,4H,8H-IMIDAZO[1,2-G]PURINE-2,4-DIONE
| Molecular Formula | C21H17ClN6O2 |
|---|---|
| Molecular Weight | 420.11 g/mol |
| LogP | 2.4501 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.11014 |
| Heavy Atoms | 30 |
| Complexity | 1524.3584 |
Chemical Identifiers
| CAS Number | 442669-06-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CC4=CC=CC=N4)C5=CC=C(C=C5)Cl |
Product Overview
A2840/0119833 (CAS 442669-06-9), with molecular formula C21H17ClN6O2 and molecular weight 420.11 g/mol. IUPAC: 7-(4-chlorophenyl)-2,4-dimethyl-6-(pyridin-2-ylmethyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of A2840/0119833
Property Insights of A2840/0119833
The XLogP value of 2.4501 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2840/0119833. The TPSA of 79.12 Ų falls within the moderate polarity range, balancing permeability and solubility for A2840/0119833. Following Lipinski's Rule of Five, A2840/0119833 has 0 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 A2840/0119833?
The CAS number of A2840/0119833 is 442669-06-9.
What is the molecular formula of A2840/0119833?
The molecular formula of A2840/0119833 is C21H17ClN6O2.
What is the molecular weight of A2840/0119833?
The molecular weight of A2840/0119833 is 420.11 g/mol.
Where can I buy A2840/0119833?
You can request a quote for A2840/0119833 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2840/0119833?
Yes, KEHONG BIO provides custom synthesis services for A2840/0119833 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.