ASN 12662429
TL;DR: ASN 12662429 (CAS 878717-69-2) is a chemical compound with molecular formula C20H20ClN5O3 and molecular weight 413.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(5-chloro-2-methylphenyl)-4,7-dimethyl-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione
Also Known As: ASN 12662429, UPCMLD0ENAT5815543:001, 6-(5-chloro-2-methylphenyl)-4,7-dimethyl-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione, 8-(5-chloro-2-methylphenyl)-1,7-dimethyl-3-(1-methyl-2-oxopropyl)-1,3,5-trihyd ro-4-imidazolino[1,2-h]purine-2,4-dione, 8-(5-chloro-2-methylphenyl)-1,7-dimethyl-3-(3-oxobutan-2-yl)-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione
| Molecular Formula | C20H20ClN5O3 |
|---|---|
| Molecular Weight | 413.13 g/mol |
| LogP | 2.55884 |
| Topological Polar Surface Area | 83.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 413.12546 |
| Heavy Atoms | 29 |
| Complexity | 1436.846 |
Chemical Identifiers
| CAS Number | 878717-69-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C(C)C(=O)C)C |
Product Overview
ASN 12662429 (CAS 878717-69-2), with molecular formula C20H20ClN5O3 and molecular weight 413.13 g/mol. IUPAC: 6-(5-chloro-2-methylphenyl)-4,7-dimethyl-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of ASN 12662429
Property Insights of ASN 12662429
The XLogP value of 2.55884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 12662429. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 12662429. Following Lipinski's Rule of Five, ASN 12662429 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 ASN 12662429?
The CAS number of ASN 12662429 is 878717-69-2.
What is the molecular formula of ASN 12662429?
The molecular formula of ASN 12662429 is C20H20ClN5O3.
What is the molecular weight of ASN 12662429?
The molecular weight of ASN 12662429 is 413.13 g/mol.
Where can I buy ASN 12662429?
You can request a quote for ASN 12662429 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 12662429?
Yes, KEHONG BIO provides custom synthesis services for ASN 12662429 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.