AB01288590-01
TL;DR: AB01288590-01 (CAS 851940-80-2) is a chemical compound with molecular formula C22H28N6O3 and molecular weight 424.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[8-[(4-benzylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetamide
Also Known As: AB01288590-01, F0634-0508, 2-{8-[(4-benzylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetamide, 2-[8-[(4-benzylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetamide, 2-[8-[(4-benzyl-1-piperidyl)methyl]-1,3-dimethyl-2,6-dioxo-purin-7-yl]acetamide
| Molecular Formula | C22H28N6O3 |
|---|---|
| Molecular Weight | 424.22 g/mol |
| LogP | 0.3737 |
| Topological Polar Surface Area | 108.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.2223 |
| Heavy Atoms | 31 |
| Complexity | 1216.0026 |
Chemical Identifiers
| CAS Number | 851940-80-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCC(CC3)CC4=CC=CC=C4)CC(=O)N |
Product Overview
AB01288590-01 (CAS 851940-80-2), with molecular formula C22H28N6O3 and molecular weight 424.22 g/mol. IUPAC: 2-[8-[(4-benzylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetamide.
Chemical Property Profile of AB01288590-01
Property Insights of AB01288590-01
The XLogP value of 0.3737 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01288590-01. The TPSA of 108.15 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01288590-01. Following Lipinski's Rule of Five, AB01288590-01 has 1 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 AB01288590-01?
The CAS number of AB01288590-01 is 851940-80-2.
What is the molecular formula of AB01288590-01?
The molecular formula of AB01288590-01 is C22H28N6O3.
What is the molecular weight of AB01288590-01?
The molecular weight of AB01288590-01 is 424.22 g/mol.
Where can I buy AB01288590-01?
You can request a quote for AB01288590-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01288590-01?
Yes, KEHONG BIO provides custom synthesis services for AB01288590-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.