![3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid structure](/static/products/890/890625-09-9.png)
3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid
TL;DR: 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid (CAS 890625-09-9) is a chemical compound with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dimethyl-1-prop-2-enylpyrazol-4-yl)-1H-pyrazole-5-carboxylic acid
Also Known As: 1'-Allyl-3',5'-dimethyl-1H,1'H-[3,4']bipyrazolyl-5-carboxylic acid, 2214AF, BAS 13299649, 1'-allyl-3',5'-dimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid, BB 0219072
| Molecular Formula | C12H14N4O2 |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 1.77424 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.11168 |
| Heavy Atoms | 18 |
| Complexity | 609.62115 |
Chemical Identifiers
| CAS Number | 890625-09-9 |
|---|---|
| SMILES | CC1=C(C(=NN1CC=C)C)C2=NNC(=C2)C(=O)O |
Product Overview
3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid (CAS 890625-09-9), with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol. IUPAC: 3-(3,5-dimethyl-1-prop-2-enylpyrazol-4-yl)-1H-pyrazole-5-carboxylic acid.
Chemical Property Profile of 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid
Property Insights of 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid
The XLogP value of 1.77424 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid. Following Lipinski's Rule of Five, 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid has 2 hydrogen bond donor(s) and 3 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 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid?
The CAS number of 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid is 890625-09-9.
What is the molecular formula of 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid?
The molecular formula of 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid is C12H14N4O2.
What is the molecular weight of 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid?
The molecular weight of 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid is 246.11 g/mol.
Where can I buy 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid?
You can request a quote for 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3',5'-dimethyl-1'-(prop-2-en-1-yl)-1H,1'H-[3,4'-bipyrazole]-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.