A2840/0119834
TL;DR: A2840/0119834 (CAS 442669-07-0) is a chemical compound with molecular formula C19H20ClN5O3 and molecular weight 401.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-chlorophenyl)-6-(3-methoxypropyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: A2840/0119834, 7-(4-chlorophenyl)-6-(3-methoxypropyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione, 7-(4-chlorophenyl)-8-(3-methoxypropyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(4-chlorophenyl)-8-(3-methoxypropyl)-1,3-dimethyl-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione
| Molecular Formula | C19H20ClN5O3 |
|---|---|
| Molecular Weight | 401.13 g/mol |
| LogP | 2.0433 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.12546 |
| Heavy Atoms | 28 |
| Complexity | 1294.0789 |
Chemical Identifiers
| CAS Number | 442669-07-0 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCCOC)C4=CC=C(C=C4)Cl |
Product Overview
A2840/0119834 (CAS 442669-07-0), with molecular formula C19H20ClN5O3 and molecular weight 401.13 g/mol. IUPAC: 7-(4-chlorophenyl)-6-(3-methoxypropyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of A2840/0119834
Property Insights of A2840/0119834
The XLogP value of 2.0433 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2840/0119834. The TPSA of 75.46 Ų falls within the moderate polarity range, balancing permeability and solubility for A2840/0119834. Following Lipinski's Rule of Five, A2840/0119834 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 A2840/0119834?
The CAS number of A2840/0119834 is 442669-07-0.
What is the molecular formula of A2840/0119834?
The molecular formula of A2840/0119834 is C19H20ClN5O3.
What is the molecular weight of A2840/0119834?
The molecular weight of A2840/0119834 is 401.13 g/mol.
Where can I buy A2840/0119834?
You can request a quote for A2840/0119834 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2840/0119834?
Yes, KEHONG BIO provides custom synthesis services for A2840/0119834 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.