![2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester structure](/static/products/6207/62078-63-1.webp)
2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester
TL;DR: 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester (CAS 62078-63-1) is a chemical compound with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-3-[(1-methyl-2-pyridinylidene)amino]prop-2-enoate
Also Known As: ethyl (E)-2-cyano-3-[(1-methylpyridin-2-ylidene)amino]prop-2, ethyl 2-cyano-3-[(1-methylpyridin-2-ylidene)amino]prop-2-enoate, 2-PROPENOIC ACID,2-CYANO-3-[(1-METHYL-2(1H)-PYRIDINYLIDENE)AMINO]-, ETHYL ESTER
| Molecular Formula | C12H13N3O2 |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.10077 |
| Heavy Atoms | 17 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 62078-63-1 |
|---|---|
| SMILES | CCOC(=O)C(=CN=C1C=CC=CN1C)C#N |
| InChIKey | PRYGRZUNFVIESU-UHFFFAOYSA-N |
Product Overview
2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester (CAS 62078-63-1), with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol. IUPAC: ethyl 2-cyano-3-[(1-methyl-2-pyridinylidene)amino]prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester
Property Insights of 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester. Following Lipinski's Rule of Five, 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester has 0 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 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester?
The CAS number of 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester is 62078-63-1.
What is the molecular formula of 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester?
The molecular formula of 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester is C12H13N3O2.
What is the molecular weight of 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester?
The molecular weight of 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester is 231.10 g/mol.
Where can I buy 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester?
You can request a quote for 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid,2-cyano-3-[(1-methyl-2(1H)-pyridinylidene)amino]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.