(2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide
TL;DR: (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide (CAS 651016-53-4) is a chemical compound with molecular formula C20H20N4O4S and molecular weight 412.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-3-(2-methoxyphenyl)prop-2-enamide
Also Known As: (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide, (E)-N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-3-(2-methoxyphenyl)prop-2-enamide, N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide, (2E)-N-[(2-{[4-(acetylamino)phenyl]carbonyl}hydrazinyl)carbonothioyl]-3-(2-methoxyphenyl)prop-2-enamide
| Molecular Formula | C20H20N4O4S |
|---|---|
| Molecular Weight | 412.12 g/mol |
| LogP | 2.0025 |
| Topological Polar Surface Area | 108.56 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.1205 |
| Heavy Atoms | 29 |
| Complexity | 941.7523 |
Chemical Identifiers
| CAS Number | 651016-53-4 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=CC=C2OC |
Product Overview
(2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide (CAS 651016-53-4), with molecular formula C20H20N4O4S and molecular weight 412.12 g/mol. IUPAC: (E)-N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-3-(2-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide
Property Insights of (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide
The XLogP value of 2.0025 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide. The TPSA of 108.56 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide. Following Lipinski's Rule of Five, (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide has 4 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 (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide?
The CAS number of (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide is 651016-53-4.
What is the molecular formula of (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide?
The molecular formula of (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide is C20H20N4O4S.
What is the molecular weight of (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide?
The molecular weight of (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide is 412.12 g/mol.
Where can I buy (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide?
You can request a quote for (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-({2-[4-(acetylamino)benzoyl]hydrazino}carbonothioyl)-3-(2-methoxyphenyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.