(E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide
TL;DR: (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide (CAS 327062-37-3) is a chemical compound with molecular formula C29H20Cl2N4OS and molecular weight 542.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(1-benzylindol-3-yl)-2-cyano-N-[5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-yl]prop-2-enamide
Also Known As: (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide, (2E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-[5-(2,5-dichlorobenzyl)-1,3-thiazol-2-yl]prop-2-enamide, (2E)-N-{5-[(2,5-dichlorophenyl)methyl](1,3-thiazol-2-yl)}-2-cyano-3-[1-benzyli ndol-3-yl]prop-2-enamide, (E)-3-(1-benzylindol-3-yl)-2-cyano-N-[5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-yl]prop-2-enamide, 3-(1-benzylindol-3-yl)-2-cyano-N-[5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-yl]prop-2-enamide
| Molecular Formula | C29H20Cl2N4OS |
|---|---|
| Molecular Weight | 542.07 g/mol |
| LogP | 7.58938 |
| Topological Polar Surface Area | 70.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 542.0735 |
| Heavy Atoms | 37 |
| Complexity | 1664.5681 |
Chemical Identifiers
| CAS Number | 327062-37-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)/C=C(\C#N)/C(=O)NC4=NC=C(S4)CC5=C(C=CC(=C5)Cl)Cl |
Product Overview
(E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide (CAS 327062-37-3), with molecular formula C29H20Cl2N4OS and molecular weight 542.07 g/mol. IUPAC: (E)-3-(1-benzylindol-3-yl)-2-cyano-N-[5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-yl]prop-2-enamide.
Chemical Property Profile of (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide
Property Insights of (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide
The XLogP value of 7.58938 indicates that (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.71 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide. Following Lipinski's Rule of Five, (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide?
The CAS number of (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide is 327062-37-3.
What is the molecular formula of (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide?
The molecular formula of (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide is C29H20Cl2N4OS.
What is the molecular weight of (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide?
The molecular weight of (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide is 542.07 g/mol.
Where can I buy (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide?
You can request a quote for (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(1-benzyl-1H-indol-3-yl)-2-cyano-N-(5-(2,5-dichlorobenzyl)thiazol-2-yl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.