![3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid structure](/static/products/1254/125407-30-9.webp)
3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid
TL;DR: 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid (CAS 125407-30-9) is a chemical compound with molecular formula C12H11NO5 and molecular weight 249.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methoxycarbonylanilino)-4-oxobut-2-enoic acid
Also Known As: 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid, 4-(4-methoxycarbonylanilino)-4-oxobut-2-enoic acid, 4-(4-methoxycarbonylanilino)-4-oxo-but-2-enoic acid, (Z)-4-(4-methoxycarbonylanilino)-4-oxobut-2-enoic acid, (Z)-4-[4-(Methoxycarbonyl)anilino]-4-oxo-2-butenoic acid
| Molecular Formula | C12H11NO5 |
|---|---|
| Molecular Weight | 249.06 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.06372 |
| Heavy Atoms | 18 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 125407-30-9 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)C=CC(=O)O |
| InChIKey | DBEKDAZTABHMRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid (CAS 125407-30-9), with molecular formula C12H11NO5 and molecular weight 249.06 g/mol. IUPAC: 4-(4-methoxycarbonylanilino)-4-oxobut-2-enoic acid.
Chemical Property Profile of 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid
Property Insights of 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid. Following Lipinski's Rule of Five, 3-[(4-methoxycarbonylphenyl)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 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid?
The CAS number of 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid is 125407-30-9.
What is the molecular formula of 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid?
The molecular formula of 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid is C12H11NO5.
What is the molecular weight of 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid?
The molecular weight of 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid is 249.06 g/mol.
Where can I buy 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid?
You can request a quote for 3-[(4-methoxycarbonylphenyl)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 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-methoxycarbonylphenyl)carbamoyl]prop-2-enoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.