ASN 12662659
TL;DR: ASN 12662659 (CAS 878718-64-0) is a chemical compound with molecular formula C19H18ClN5O4 and molecular weight 415.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[6-(2-chlorophenyl)-4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]propanoate
Also Known As: ASN 12662659, UPCMLD0ENAT5815558:001, methyl 2-[6-(2-chlorophenyl)-4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]propanoate, methyl 2-[8-(2-chlorophenyl)-1,7-dimethyl-2,4-dioxo-1,3,5-trihydro-4-imidazoli no[1,2-h]purin-3-yl]propanoate, methyl 2-[8-(2-chlorophenyl)-1,7-dimethyl-2,4-dioxo-1H,2H,3H,4H,8H-imidazo[1,2-g]purin-3-yl]propanoate
| Molecular Formula | C19H18ClN5O4 |
|---|---|
| Molecular Weight | 415.10 g/mol |
| LogP | 1.83442 |
| Topological Polar Surface Area | 92.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.10474 |
| Heavy Atoms | 29 |
| Complexity | 1408.2402 |
Chemical Identifiers
| CAS Number | 878718-64-0 |
|---|---|
| SMILES | CC1=CN2C3=C(N=C2N1C4=CC=CC=C4Cl)N(C(=O)N(C3=O)C(C)C(=O)OC)C |
Product Overview
ASN 12662659 (CAS 878718-64-0), with molecular formula C19H18ClN5O4 and molecular weight 415.10 g/mol. IUPAC: methyl 2-[6-(2-chlorophenyl)-4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-2-yl]propanoate.
Chemical Property Profile of ASN 12662659
Property Insights of ASN 12662659
The XLogP value of 1.83442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 12662659. The TPSA of 92.53 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 12662659. Following Lipinski's Rule of Five, ASN 12662659 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 ASN 12662659?
The CAS number of ASN 12662659 is 878718-64-0.
What is the molecular formula of ASN 12662659?
The molecular formula of ASN 12662659 is C19H18ClN5O4.
What is the molecular weight of ASN 12662659?
The molecular weight of ASN 12662659 is 415.10 g/mol.
Where can I buy ASN 12662659?
You can request a quote for ASN 12662659 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 12662659?
Yes, KEHONG BIO provides custom synthesis services for ASN 12662659 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.