AB01276548-01
TL;DR: AB01276548-01 (CAS 847572-56-9) is a chemical compound with molecular formula C22H21F2N5O2 and molecular weight 425.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-(4-fluorophenyl)ethylamino]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
Also Known As: AB01276548-01, 7-(4-fluorobenzyl)-8-{[2-(4-fluorophenyl)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 8-[2-(4-fluorophenyl)ethylamino]-7-[(4-fluorophenyl)methyl]-1,3-dimethyl-purine-2,6-dione, 8-[2-(4-fluorophenyl)ethylamino]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione, 1H-Purine-2,6-dione, 8-[[2-(4-fluorophenyl)ethyl]amino]-7-[(4-fluorophenyl)methyl]-3,7-dihydro-1,3-dimethyl-
| Molecular Formula | C22H21F2N5O2 |
|---|---|
| Molecular Weight | 425.17 g/mol |
| LogP | 2.4148 |
| Topological Polar Surface Area | 73.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 425.16632 |
| Heavy Atoms | 31 |
| Complexity | 1352.6632 |
Chemical Identifiers
| CAS Number | 847572-56-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCC3=CC=C(C=C3)F)CC4=CC=C(C=C4)F |
Product Overview
AB01276548-01 (CAS 847572-56-9), with molecular formula C22H21F2N5O2 and molecular weight 425.17 g/mol. IUPAC: 8-[2-(4-fluorophenyl)ethylamino]-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of AB01276548-01
Property Insights of AB01276548-01
The XLogP value of 2.4148 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01276548-01. The TPSA of 73.85 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01276548-01. Following Lipinski's Rule of Five, AB01276548-01 has 1 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 AB01276548-01?
The CAS number of AB01276548-01 is 847572-56-9.
What is the molecular formula of AB01276548-01?
The molecular formula of AB01276548-01 is C22H21F2N5O2.
What is the molecular weight of AB01276548-01?
The molecular weight of AB01276548-01 is 425.17 g/mol.
Where can I buy AB01276548-01?
You can request a quote for AB01276548-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01276548-01?
Yes, KEHONG BIO provides custom synthesis services for AB01276548-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.