ASN 12663411
TL;DR: ASN 12663411 (CAS 878720-44-6) is a chemical compound with molecular formula C20H20ClN5O2 and molecular weight 397.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methyl]-4,7,8-trimethyl-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione
Also Known As: ASN 12663411, 2-[(4-chlorophenyl)methyl]-4,7,8-trimethyl-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione, 3-[(4-chlorophenyl)methyl]-1,6,7-trimethyl-8-(prop-2-en-1-yl)-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione, 3-[(4-chlorophenyl)methyl]-1,6,7-trimethyl-8-prop-2-enyl-1,3,5-trihydro-4-imid azolino[1,2-h]purine-2,4-dione
| Molecular Formula | C20H20ClN5O2 |
|---|---|
| Molecular Weight | 397.13 g/mol |
| LogP | 2.65394 |
| Topological Polar Surface Area | 66.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.13055 |
| Heavy Atoms | 28 |
| Complexity | 1352.4952 |
Chemical Identifiers
| CAS Number | 878720-44-6 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CC=C)N(C(=O)N(C3=O)CC4=CC=C(C=C4)Cl)C)C |
Product Overview
ASN 12663411 (CAS 878720-44-6), with molecular formula C20H20ClN5O2 and molecular weight 397.13 g/mol. IUPAC: 2-[(4-chlorophenyl)methyl]-4,7,8-trimethyl-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of ASN 12663411
Property Insights of ASN 12663411
The XLogP value of 2.65394 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 12663411. The TPSA of 66.23 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 12663411. Following Lipinski's Rule of Five, ASN 12663411 has 0 hydrogen bond donor(s) and 3 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 12663411?
The CAS number of ASN 12663411 is 878720-44-6.
What is the molecular formula of ASN 12663411?
The molecular formula of ASN 12663411 is C20H20ClN5O2.
What is the molecular weight of ASN 12663411?
The molecular weight of ASN 12663411 is 397.13 g/mol.
Where can I buy ASN 12663411?
You can request a quote for ASN 12663411 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 12663411?
Yes, KEHONG BIO provides custom synthesis services for ASN 12663411 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.