![(2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID structure](/static/products/5405/540530-34-5.webp)
(2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID
TL;DR: (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID (CAS 540530-34-5) is a chemical compound with molecular formula C14H17NO5S and molecular weight 311.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[(3-ethoxycarbonyl-4-ethyl-5-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid
Also Known As: (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID, (E)-4-[(3-ethoxycarbonyl-4-ethyl-5-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid, 3-[(3-ethoxycarbonyl-4-ethyl-5-methyl-thiophen-2-yl)carbamoyl]prop-2-enoic Acid, 4-{[3-(ethoxycarbonyl)-4-ethyl-5-methyl-2-thienyl]amino}-4-oxo-2-butenoic acid
| Molecular Formula | C14H17NO5S |
|---|---|
| Molecular Weight | 311.08 g/mol |
| LogP | 2.37492 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.08273 |
| Heavy Atoms | 21 |
| Complexity | 588.43 |
Chemical Identifiers
| CAS Number | 540530-34-5 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)OCC)NC(=O)/C=C/C(=O)O)C |
Product Overview
(2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID (CAS 540530-34-5), with molecular formula C14H17NO5S and molecular weight 311.08 g/mol. IUPAC: (E)-4-[(3-ethoxycarbonyl-4-ethyl-5-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid.
Chemical Property Profile of (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID
Property Insights of (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID
The XLogP value of 2.37492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID. Following Lipinski's Rule of Five, (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID has 2 hydrogen bond donor(s) and 5 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 (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID?
The CAS number of (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID is 540530-34-5.
What is the molecular formula of (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID?
The molecular formula of (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID is C14H17NO5S.
What is the molecular weight of (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID?
The molecular weight of (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID is 311.08 g/mol.
Where can I buy (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID?
You can request a quote for (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-3-{[3-(ETHOXYCARBONYL)-4-ETHYL-5-METHYLTHIOPHEN-2-YL]CARBAMOYL}PROP-2-ENOIC ACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.