RefChem:237823
TL;DR: RefChem:237823 (CAS 96885-61-9) is a chemical compound with molecular formula C23H21N5O3 and molecular weight 415.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-methoxyphenyl)-2,4-dimethyl-7-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: 1H-Imidazo(2,1-f)purine-2,4(3H,8H)-dione, 1,3-dimethyl-8-(4-methoxyphenyl)-7-(4-methylphenyl)-, 1,3-Dimethyl-8-(4-methoxyphenyl)-7-(4-methylphenyl)-1H-imidazo(2,1-f)purine-2,4(3H,8H)-dione, A3980/0169511, 6-(4-methoxyphenyl)-2,4-dimethyl-7-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione, 8-(4-methoxyphenyl)-1,3-dimethyl-7-(4-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C23H21N5O3 |
|---|---|
| Molecular Weight | 415.16 g/mol |
| LogP | 2.65962 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.16443 |
| Heavy Atoms | 31 |
| Complexity | 1565.3618 |
Chemical Identifiers
| CAS Number | 96885-61-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2C5=CC=C(C=C5)OC)N(C(=O)N(C4=O)C)C |
Product Overview
RefChem:237823 (CAS 96885-61-9), with molecular formula C23H21N5O3 and molecular weight 415.16 g/mol. IUPAC: 6-(4-methoxyphenyl)-2,4-dimethyl-7-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of RefChem:237823
Property Insights of RefChem:237823
The XLogP value of 2.65962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:237823. The TPSA of 75.46 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:237823. Following Lipinski's Rule of Five, RefChem:237823 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 RefChem:237823?
The CAS number of RefChem:237823 is 96885-61-9.
What is the molecular formula of RefChem:237823?
The molecular formula of RefChem:237823 is C23H21N5O3.
What is the molecular weight of RefChem:237823?
The molecular weight of RefChem:237823 is 415.16 g/mol.
Where can I buy RefChem:237823?
You can request a quote for RefChem:237823 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:237823?
Yes, KEHONG BIO provides custom synthesis services for RefChem:237823 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.