AB00772829-01
TL;DR: AB00772829-01 (CAS 893974-52-2) is a chemical compound with molecular formula C22H20ClN5O3 and molecular weight 437.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chlorophenyl)methyl]-6-(2-methoxyphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
Also Known As: AB00772829-01, 3-(2-chlorobenzyl)-8-(2-methoxyphenyl)-1-methyl-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione, 3-[(2-chlorophenyl)methyl]-8-(2-methoxyphenyl)-1-methyl-1,3,5-trihydroimidazol idino[1,2-h]purine-2,4-dione, 2-[(2-chlorophenyl)methyl]-6-(2-methoxyphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione
| Molecular Formula | C22H20ClN5O3 |
|---|---|
| Molecular Weight | 437.13 g/mol |
| LogP | 2.7587 |
| Topological Polar Surface Area | 74.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 437.12546 |
| Heavy Atoms | 31 |
| Complexity | 1435.5935 |
Chemical Identifiers
| CAS Number | 893974-52-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3Cl)N4CCN(C4=N2)C5=CC=CC=C5OC |
Product Overview
AB00772829-01 (CAS 893974-52-2), with molecular formula C22H20ClN5O3 and molecular weight 437.13 g/mol. IUPAC: 2-[(2-chlorophenyl)methyl]-6-(2-methoxyphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of AB00772829-01
Property Insights of AB00772829-01
The XLogP value of 2.7587 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00772829-01. The TPSA of 74.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00772829-01. Following Lipinski's Rule of Five, AB00772829-01 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 AB00772829-01?
The CAS number of AB00772829-01 is 893974-52-2.
What is the molecular formula of AB00772829-01?
The molecular formula of AB00772829-01 is C22H20ClN5O3.
What is the molecular weight of AB00772829-01?
The molecular weight of AB00772829-01 is 437.13 g/mol.
Where can I buy AB00772829-01?
You can request a quote for AB00772829-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00772829-01?
Yes, KEHONG BIO provides custom synthesis services for AB00772829-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.