![(Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid structure](/static/products/956/956930-27-1.png)
(Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid
TL;DR: (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid (CAS 956930-27-1) is a chemical compound with molecular formula C17H18N4O5 and molecular weight 358.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[6-(4-ethoxycarbonyl-3,5-dimethylpyrazol-1-yl)-3-pyridinyl]amino]-4-oxobut-2-enoic acid
Also Known As: (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid, 3-[[6-(4-ethoxycarbonyl-3,5-dimethyl-pyrazol-1-yl)pyridin-3-yl]carbamoyl]prop-2-enoic Acid, 4-[[6-(4-ethoxycarbonyl-3,5-dimethylpyrazol-1-yl)pyridin-3-yl]amino]-4-oxobut-2-enoic acid
| Molecular Formula | C17H18N4O5 |
|---|---|
| Molecular Weight | 358.13 g/mol |
| LogP | 1.64014 |
| Topological Polar Surface Area | 123.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.12772 |
| Heavy Atoms | 26 |
| Complexity | 868.02356 |
Chemical Identifiers
| CAS Number | 956930-27-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1C)C2=NC=C(C=C2)NC(=O)C=CC(=O)O)C |
Product Overview
(Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid (CAS 956930-27-1), with molecular formula C17H18N4O5 and molecular weight 358.13 g/mol. IUPAC: 4-[[6-(4-ethoxycarbonyl-3,5-dimethylpyrazol-1-yl)-3-pyridinyl]amino]-4-oxobut-2-enoic acid.
Chemical Property Profile of (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid
Property Insights of (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid
The XLogP value of 1.64014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid. The TPSA of 123.41 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid. Following Lipinski's Rule of Five, (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid has 2 hydrogen bond donor(s) and 6 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 (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid?
The CAS number of (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid is 956930-27-1.
What is the molecular formula of (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid?
The molecular formula of (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid is C17H18N4O5.
What is the molecular weight of (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid?
The molecular weight of (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid is 358.13 g/mol.
Where can I buy (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid?
You can request a quote for (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-({6-[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrazol-1-yl]-3-pyridinyl}amino)-4-oxo-2-butenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.