AB00772641-01
TL;DR: AB00772641-01 (CAS 848753-84-4) is a chemical compound with molecular formula C24H24ClN5O4 and molecular weight 481.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chlorophenyl)methyl]-9-(4-ethoxyphenyl)-7-hydroxy-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: AB00772641-01, 3-(4-chlorobenzyl)-9-(4-ethoxyphenyl)-7-hydroxy-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, 3-[(4-chlorophenyl)methyl]-9-(4-ethoxyphenyl)-7-hydroxy-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione, 3-[(4-chlorophenyl)methyl]-9-(4-ethoxyphenyl)-7-hydroxy-1-methyl-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione, 3-[(4-chlorophenyl)methyl]-9-(4-ethoxyphenyl)-7-hydroxy-1-methyl-1,3,5-trihydr o-6H,7H,8H-1,3-diazaperhydroino[1,2-h]purine-2,4-dione
| Molecular Formula | C24H24ClN5O4 |
|---|---|
| Molecular Weight | 481.15 g/mol |
| LogP | 2.5097 |
| Topological Polar Surface Area | 94.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 481.15167 |
| Heavy Atoms | 34 |
| Complexity | 1471.2587 |
Chemical Identifiers
| CAS Number | 848753-84-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2CC(CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=C(C=C5)Cl)O |
Product Overview
AB00772641-01 (CAS 848753-84-4), with molecular formula C24H24ClN5O4 and molecular weight 481.15 g/mol. IUPAC: 3-[(4-chlorophenyl)methyl]-9-(4-ethoxyphenyl)-7-hydroxy-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.
Chemical Property Profile of AB00772641-01
Property Insights of AB00772641-01
The XLogP value of 2.5097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00772641-01. The TPSA of 94.52 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00772641-01. Following Lipinski's Rule of Five, AB00772641-01 has 1 hydrogen bond donor(s) and 6 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 AB00772641-01?
The CAS number of AB00772641-01 is 848753-84-4.
What is the molecular formula of AB00772641-01?
The molecular formula of AB00772641-01 is C24H24ClN5O4.
What is the molecular weight of AB00772641-01?
The molecular weight of AB00772641-01 is 481.15 g/mol.
Where can I buy AB00772641-01?
You can request a quote for AB00772641-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00772641-01?
Yes, KEHONG BIO provides custom synthesis services for AB00772641-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.