![N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide structure](/static/products/649/649753-47-9.png)
N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide
TL;DR: N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide (CAS 649753-47-9) is a chemical compound with molecular formula C17H16N4O3S and molecular weight 356.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-methoxyphenyl)-N-[(pyridine-4-carbonylamino)carbamothioyl]prop-2-enamide
Also Known As: N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide, (E)-3-(4-methoxyphenyl)-N-[(pyridine-4-carbonylamino)carbamothioyl]prop-2-enamide, (2E)-3-(4-methoxyphenyl)-N-{[2-(pyridin-4-ylcarbonyl)hydrazinyl]carbonothioyl}prop-2-enamide
| Molecular Formula | C17H16N4O3S |
|---|---|
| Molecular Weight | 356.09 g/mol |
| LogP | 1.4391 |
| Topological Polar Surface Area | 92.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.0943 |
| Heavy Atoms | 25 |
| Complexity | 776.2398 |
Chemical Identifiers
| CAS Number | 649753-47-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC=NC=C2 |
Product Overview
N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide (CAS 649753-47-9), with molecular formula C17H16N4O3S and molecular weight 356.09 g/mol. IUPAC: (E)-3-(4-methoxyphenyl)-N-[(pyridine-4-carbonylamino)carbamothioyl]prop-2-enamide.
Chemical Property Profile of N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide
Property Insights of N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide
The XLogP value of 1.4391 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide. The TPSA of 92.35 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide. Following Lipinski's Rule of Five, N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide has 3 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 N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide?
The CAS number of N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide is 649753-47-9.
What is the molecular formula of N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide?
The molecular formula of N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide is C17H16N4O3S.
What is the molecular weight of N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide?
The molecular weight of N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide is 356.09 g/mol.
Where can I buy N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide?
You can request a quote for N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-isonicotinoylhydrazino)carbonothioyl]-3-(4-methoxyphenyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.