AB00773559-01
TL;DR: AB00773559-01 (CAS 893979-22-1) is a chemical compound with molecular formula C22H20ClN5O2 and molecular weight 421.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-chlorophenyl)-4-methyl-2-[(2-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
Also Known As: AB00773559-01, 8-(3-chlorophenyl)-1-methyl-3-(2-methylbenzyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione, 8-(3-chlorophenyl)-1-methyl-3-[(2-methylphenyl)methyl]-1,3,5-trihydroimidazoli dino[1,2-h]purine-2,4-dione, 6-(3-chlorophenyl)-4-methyl-2-[(2-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
| Molecular Formula | C22H20ClN5O2 |
|---|---|
| Molecular Weight | 421.13 g/mol |
| LogP | 3.05852 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.13055 |
| Heavy Atoms | 30 |
| Complexity | 1415.5533 |
Chemical Identifiers
| CAS Number | 893979-22-1 |
|---|---|
| SMILES | CC1=CC=CC=C1CN2C(=O)C3=C(N=C4N3CCN4C5=CC(=CC=C5)Cl)N(C2=O)C |
Product Overview
AB00773559-01 (CAS 893979-22-1), with molecular formula C22H20ClN5O2 and molecular weight 421.13 g/mol. IUPAC: 6-(3-chlorophenyl)-4-methyl-2-[(2-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of AB00773559-01
Property Insights of AB00773559-01
The XLogP value of 3.05852 indicates that AB00773559-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00773559-01. Following Lipinski's Rule of Five, AB00773559-01 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 AB00773559-01?
The CAS number of AB00773559-01 is 893979-22-1.
What is the molecular formula of AB00773559-01?
The molecular formula of AB00773559-01 is C22H20ClN5O2.
What is the molecular weight of AB00773559-01?
The molecular weight of AB00773559-01 is 421.13 g/mol.
Where can I buy AB00773559-01?
You can request a quote for AB00773559-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00773559-01?
Yes, KEHONG BIO provides custom synthesis services for AB00773559-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.