AB00433935-10
TL;DR: AB00433935-10 (CAS 840482-39-5) is a chemical compound with molecular formula C26H29ClN6O2 and molecular weight 492.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(4-benzylpiperazin-1-yl)methyl]-7-[(4-chlorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
Also Known As: AB00433935-10, AB00433935-12, 8-[(4-benzylpiperazin-1-yl)methyl]-7-[(4-chlorophenyl)methyl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 8-[(4-benzylpiperazin-1-yl)methyl]-7-[(4-chlorophenyl)methyl]-1,3-dimethylpurine-2,6-dione, 8-((4-benzylpiperazin-1-yl)methyl)-7-(4-chlorobenzyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C26H29ClN6O2 |
|---|---|
| Molecular Weight | 492.20 g/mol |
| LogP | 2.4532 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 492.20404 |
| Heavy Atoms | 35 |
| Complexity | 1447.9664 |
Chemical Identifiers
| CAS Number | 840482-39-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)CC4=CC=CC=C4)CC5=CC=C(C=C5)Cl |
Product Overview
AB00433935-10 (CAS 840482-39-5), with molecular formula C26H29ClN6O2 and molecular weight 492.20 g/mol. IUPAC: 8-[(4-benzylpiperazin-1-yl)methyl]-7-[(4-chlorophenyl)methyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of AB00433935-10
Property Insights of AB00433935-10
The XLogP value of 2.4532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00433935-10. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00433935-10. Following Lipinski's Rule of Five, AB00433935-10 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 AB00433935-10?
The CAS number of AB00433935-10 is 840482-39-5.
What is the molecular formula of AB00433935-10?
The molecular formula of AB00433935-10 is C26H29ClN6O2.
What is the molecular weight of AB00433935-10?
The molecular weight of AB00433935-10 is 492.20 g/mol.
Where can I buy AB00433935-10?
You can request a quote for AB00433935-10 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00433935-10?
Yes, KEHONG BIO provides custom synthesis services for AB00433935-10 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.