![3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid structure](/static/products/2812/281223-65-2.webp)
3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid
TL;DR: 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid (CAS 281223-65-2) is a chemical compound with molecular formula C10H10N2O3 and molecular weight 206.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-(pyridin-4-ylmethylamino)but-2-enoic acid
Also Known As: 3-{[(pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid, 4-oxo-4-(pyridin-4-ylmethylamino)but-2-enoic acid, 3-[(pyridin-4-ylmethyl)carbamoyl]prop-2-enoic acid, 4-oxo-4-[(pyridin-4-ylmethyl)amino]but-2-enoic acid
| Molecular Formula | C10H10N2O3 |
|---|---|
| Molecular Weight | 206.07 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 79.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.06914 |
| Heavy Atoms | 15 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 281223-65-2 |
|---|---|
| SMILES | C1=CN=CC=C1CNC(=O)C=CC(=O)O |
| InChIKey | HMJYNRJQALRSFU-UHFFFAOYSA-N |
Product Overview
3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid (CAS 281223-65-2), with molecular formula C10H10N2O3 and molecular weight 206.07 g/mol. IUPAC: 4-oxo-4-(pyridin-4-ylmethylamino)but-2-enoic acid.
Chemical Property Profile of 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid
Property Insights of 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid
The XLogP value of -0.3 indicates that 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid. Following Lipinski's Rule of Five, 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic 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 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid?
The CAS number of 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid is 281223-65-2.
What is the molecular formula of 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid?
The molecular formula of 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid is C10H10N2O3.
What is the molecular weight of 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid?
The molecular weight of 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid is 206.07 g/mol.
Where can I buy 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid?
You can request a quote for 3-{[(Pyridin-4-yl)methyl]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-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[(Pyridin-4-yl)methyl]carbamoyl}prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.