S-4-MeO-PHA
TL;DR: S-4-MeO-PHA (CAS 4819-53-8) is a chemical compound with molecular formula C14H12N6O2 and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[([1,2,4]triazolo[4,3-b]pyridazin-6-ylhydrazinylidene)methyl]benzoate
Also Known As: S-4-MeO-PHA, methyl 4-[([1,2,4]triazolo[4,3-b]pyridazin-6-ylhydrazinylidene)methyl]benzoate, Methyl 4-{[2-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)hydrazinylidene]methyl}benzoate, METHYL 4-[(1,2,7,8-TETRAZABICYCLO[4.3.0]NONA-2,4,6,8-TETRAEN-3-YLHYDRAZINYLIDENE)METHYL]BENZOATE
| Molecular Formula | C14H12N6O2 |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 1.3569 |
| Topological Polar Surface Area | 93.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.10217 |
| Heavy Atoms | 22 |
| Complexity | 824.72516 |
Chemical Identifiers
| CAS Number | 4819-53-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C=NNC2=NN3C=NN=C3C=C2 |
Product Overview
S-4-MeO-PHA (CAS 4819-53-8), with molecular formula C14H12N6O2 and molecular weight 296.10 g/mol. IUPAC: methyl 4-[([1,2,4]triazolo[4,3-b]pyridazin-6-ylhydrazinylidene)methyl]benzoate.
Chemical Property Profile of S-4-MeO-PHA
Property Insights of S-4-MeO-PHA
The XLogP value of 1.3569 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-4-MeO-PHA. The TPSA of 93.77 Ų falls within the moderate polarity range, balancing permeability and solubility for S-4-MeO-PHA. Following Lipinski's Rule of Five, S-4-MeO-PHA has 1 hydrogen bond donor(s) and 7 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 S-4-MeO-PHA?
The CAS number of S-4-MeO-PHA is 4819-53-8.
What is the molecular formula of S-4-MeO-PHA?
The molecular formula of S-4-MeO-PHA is C14H12N6O2.
What is the molecular weight of S-4-MeO-PHA?
The molecular weight of S-4-MeO-PHA is 296.10 g/mol.
Where can I buy S-4-MeO-PHA?
You can request a quote for S-4-MeO-PHA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-4-MeO-PHA?
Yes, KEHONG BIO provides custom synthesis services for S-4-MeO-PHA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.