AB00685309-01
TL;DR: AB00685309-01 (CAS 377063-52-0) is a chemical compound with molecular formula C17H17FN6O2 and molecular weight 356.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione
Also Known As: AB00685309-01, AB00685309-02, (E)-7-allyl-8-(2-(4-fluorobenzylidene)hydrazinyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, F0839-0019, 8-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione
| Molecular Formula | C17H17FN6O2 |
|---|---|
| Molecular Weight | 356.14 g/mol |
| LogP | 1.2048 |
| Topological Polar Surface Area | 86.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.1397 |
| Heavy Atoms | 26 |
| Complexity | 1121.3362 |
Chemical Identifiers
| CAS Number | 377063-52-0 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N/N=C/C3=CC=C(C=C3)F)CC=C |
Product Overview
AB00685309-01 (CAS 377063-52-0), with molecular formula C17H17FN6O2 and molecular weight 356.14 g/mol. IUPAC: 8-[(2E)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione.
Chemical Property Profile of AB00685309-01
Property Insights of AB00685309-01
The XLogP value of 1.2048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00685309-01. The TPSA of 86.21 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685309-01. Following Lipinski's Rule of Five, AB00685309-01 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 AB00685309-01?
The CAS number of AB00685309-01 is 377063-52-0.
What is the molecular formula of AB00685309-01?
The molecular formula of AB00685309-01 is C17H17FN6O2.
What is the molecular weight of AB00685309-01?
The molecular weight of AB00685309-01 is 356.14 g/mol.
Where can I buy AB00685309-01?
You can request a quote for AB00685309-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685309-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685309-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.