ASN 12662449
TL;DR: ASN 12662449 (CAS 878717-75-0) is a chemical compound with molecular formula C21H23N5O3 and molecular weight 393.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,8-trimethyl-6-(2-methylphenyl)-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione
Also Known As: ASN 12662449, 4,7,8-trimethyl-6-(2-methylphenyl)-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione, 1,6,7-trimethyl-3-(1-methyl-2-oxopropyl)-8-(2-methylphenyl)-1,3,5-trihydro-4-i midazolino[1,2-h]purine-2,4-dione, 1,6,7-trimethyl-8-(2-methylphenyl)-3-(3-oxobutan-2-yl)-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione
| Molecular Formula | C21H23N5O3 |
|---|---|
| Molecular Weight | 393.18 g/mol |
| LogP | 2.21386 |
| Topological Polar Surface Area | 83.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.18008 |
| Heavy Atoms | 29 |
| Complexity | 1431.0458 |
Chemical Identifiers
| CAS Number | 878717-75-0 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=C(N3C2=NC4=C3C(=O)N(C(=O)N4C)C(C)C(=O)C)C)C |
Product Overview
ASN 12662449 (CAS 878717-75-0), with molecular formula C21H23N5O3 and molecular weight 393.18 g/mol. IUPAC: 4,7,8-trimethyl-6-(2-methylphenyl)-2-(3-oxobutan-2-yl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of ASN 12662449
Property Insights of ASN 12662449
The XLogP value of 2.21386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 12662449. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 12662449. Following Lipinski's Rule of Five, ASN 12662449 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 12662449?
The CAS number of ASN 12662449 is 878717-75-0.
What is the molecular formula of ASN 12662449?
The molecular formula of ASN 12662449 is C21H23N5O3.
What is the molecular weight of ASN 12662449?
The molecular weight of ASN 12662449 is 393.18 g/mol.
Where can I buy ASN 12662449?
You can request a quote for ASN 12662449 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 12662449?
Yes, KEHONG BIO provides custom synthesis services for ASN 12662449 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.