AB00775117-01
TL;DR: AB00775117-01 (CAS 877617-01-1) is a chemical compound with molecular formula C24H24ClN5O4 and molecular weight 481.15167 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-chlorophenyl)methyl]-9-(2,4-dimethoxyphenyl)-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: AB00775117-01, F2013-0669, 3-[(4-chlorophenyl)methyl]-9-(2,4-dimethoxyphenyl)-1-methyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione, 3-(4-chlorobenzyl)-9-(2,4-dimethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, 3-[(4-chlorophenyl)methyl]-9-(2,4-dimethoxyphenyl)-1-methyl-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione
Technical Specifications
| Molecular Formula | C24H24ClN5O4 |
| Molecular Weight | 481.15167 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 80.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 481.15167 Da |
| Heavy Atoms | 34 |
| Complexity | 766.0 |
| SMILES | CN1C2=C(C(=O)N(C1=O)CC3=CC=C(C=C3)Cl)N4CCCN(C4=N2)C5=C(C=C(C=C5)OC)OC |
| InChIKey | NDZPXJBIRDZIFY-UHFFFAOYSA-N |
Chemical Property Profile of AB00775117-01
Property Insights of AB00775117-01
The XLogP value of 3.7 indicates that AB00775117-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00775117-01. Following Lipinski's Rule of Five, AB00775117-01 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AB00775117-01?
The CAS number of AB00775117-01 is 877617-01-1.
What is the molecular formula of AB00775117-01?
The molecular formula of AB00775117-01 is C24H24ClN5O4.
What is the molecular weight of AB00775117-01?
The molecular weight of AB00775117-01 is 481.15167 g/mol.
Where can I buy AB00775117-01?
You can request a quote for AB00775117-01 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AB00775117-01?
Yes, CoreyChem provides custom synthesis services for AB00775117-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.