1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine
TL;DR: 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine (CAS 52494-49-2) is a chemical compound with molecular formula C18H18N6 and molecular weight 318.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(3,5-dimethylpyrazol-1-yl)phthalazine
Also Known As: 1,4-bis(3,5-dimethylpyrazol-1-yl)phthalazine, 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine
| Molecular Formula | C18H18N6 |
|---|---|
| Molecular Weight | 318.16 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.1593 |
| Heavy Atoms | 24 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 52494-49-2 |
|---|---|
| SMILES | CC1=CC(=NN1C2=NN=C(C3=CC=CC=C32)N4C(=CC(=N4)C)C)C |
| InChIKey | VUMXZAJZOBWCAY-UHFFFAOYSA-N |
Product Overview
1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine (CAS 52494-49-2), with molecular formula C18H18N6 and molecular weight 318.16 g/mol. IUPAC: 1,4-bis(3,5-dimethylpyrazol-1-yl)phthalazine.
Chemical Property Profile of 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine
Property Insights of 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine
The XLogP value of 3.3 indicates that 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine. Following Lipinski's Rule of Five, 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine 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 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine?
The CAS number of 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine is 52494-49-2.
What is the molecular formula of 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine?
The molecular formula of 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine is C18H18N6.
What is the molecular weight of 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine?
The molecular weight of 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine is 318.16 g/mol.
Where can I buy 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine?
You can request a quote for 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(3,5-dimethyl-1H-pyrazol-1-yl)phthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.