3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide
TL;DR: 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide (CAS 1002407-38-6) is a chemical compound with molecular formula C14H13ClN2O3 and molecular weight 292.06146 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-prop-2-enylprop-2-enamide
Also Known As: (E)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-prop-2-enylprop-2-enamide, 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide
Technical Specifications
| Molecular Formula | C14H13ClN2O3 |
| Molecular Weight | 292.06146 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 82.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.06146 Da |
| Heavy Atoms | 20 |
| Complexity | 441.0 |
| SMILES | COC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)NCC=C)Cl)O |
| InChIKey | HYPKYMSBDRPUSD-BJMVGYQFSA-N |
Chemical Property Profile of 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide
Property Insights of 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide. The TPSA of 82.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide. Following Lipinski's Rule of Five, 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide 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
What is the CAS number of 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide?
The CAS number of 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide is 1002407-38-6.
What is the molecular formula of 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide?
The molecular formula of 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide is C14H13ClN2O3.
What is the molecular weight of 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide?
The molecular weight of 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide is 292.06146 g/mol.
Where can I buy 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide?
You can request a quote for 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide?
Yes, CoreyChem provides custom synthesis services for 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.