SDCCGSBI-0659841.P001
TL;DR: SDCCGSBI-0659841.P001 (CAS 587006-52-8) is a chemical compound with molecular formula C22H22ClN5O2 and molecular weight 423.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[benzyl(methyl)amino]-1-[(2-chlorophenyl)methyl]-3,7-dimethylpurine-2,6-dione
Also Known As: SDCCGSBI-0659841.P001, VU0607827-1, 8-(benzyl(methyl)amino)-1-(2-chlorobenzyl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione, AB01305656-01, F3260-0481
| Molecular Formula | C22H22ClN5O2 |
|---|---|
| Molecular Weight | 423.15 g/mol |
| LogP | 2.7718 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.1462 |
| Heavy Atoms | 30 |
| Complexity | 1337.6396 |
Chemical Identifiers
| CAS Number | 587006-52-8 |
|---|---|
| SMILES | CN1C2=C(N=C1N(C)CC3=CC=CC=C3)N(C(=O)N(C2=O)CC4=CC=CC=C4Cl)C |
Product Overview
SDCCGSBI-0659841.P001 (CAS 587006-52-8), with molecular formula C22H22ClN5O2 and molecular weight 423.15 g/mol. IUPAC: 8-[benzyl(methyl)amino]-1-[(2-chlorophenyl)methyl]-3,7-dimethylpurine-2,6-dione.
Chemical Property Profile of SDCCGSBI-0659841.P001
Property Insights of SDCCGSBI-0659841.P001
The XLogP value of 2.7718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SDCCGSBI-0659841.P001. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for SDCCGSBI-0659841.P001. Following Lipinski's Rule of Five, SDCCGSBI-0659841.P001 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 SDCCGSBI-0659841.P001?
The CAS number of SDCCGSBI-0659841.P001 is 587006-52-8.
What is the molecular formula of SDCCGSBI-0659841.P001?
The molecular formula of SDCCGSBI-0659841.P001 is C22H22ClN5O2.
What is the molecular weight of SDCCGSBI-0659841.P001?
The molecular weight of SDCCGSBI-0659841.P001 is 423.15 g/mol.
Where can I buy SDCCGSBI-0659841.P001?
You can request a quote for SDCCGSBI-0659841.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SDCCGSBI-0659841.P001?
Yes, KEHONG BIO provides custom synthesis services for SDCCGSBI-0659841.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.