4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid
TL;DR: 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid (CAS 876667-29-7) is a chemical compound with molecular formula C16H16N4O3 and molecular weight 312.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1-ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid
Also Known As: BAS 12533582, 4-[(1-ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid, 4-((1-ethyl-1H-pyrazolo[3,4-b]quinolin-3-yl)amino)-4-oxobutanoic acid, N-(1-Ethyl-1H-pyrazolo[3,4-b]quinolin-3-yl)-succinamic acid, 4-{[(3Z)-1-ethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]amino}-4-oxobutanoic acid
| Molecular Formula | C16H16N4O3 |
|---|---|
| Molecular Weight | 312.12 g/mol |
| LogP | 2.4077 |
| Topological Polar Surface Area | 97.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.12225 |
| Heavy Atoms | 23 |
| Complexity | 900.8631 |
Chemical Identifiers
| CAS Number | 876667-29-7 |
|---|---|
| SMILES | CCN1C2=NC3=CC=CC=C3C=C2C(=N1)NC(=O)CCC(=O)O |
Product Overview
4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid (CAS 876667-29-7), with molecular formula C16H16N4O3 and molecular weight 312.12 g/mol. IUPAC: 4-[(1-ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid.
Chemical Property Profile of 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid
Property Insights of 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid
The XLogP value of 2.4077 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid. The TPSA of 97.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid has 2 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 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid?
The CAS number of 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid is 876667-29-7.
What is the molecular formula of 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid?
The molecular formula of 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid is C16H16N4O3.
What is the molecular weight of 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid?
The molecular weight of 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid is 312.12 g/mol.
Where can I buy 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid?
You can request a quote for 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(1-Ethylpyrazolo[3,4-b]quinolin-3-yl)amino]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.