(e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide
TL;DR: (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide (CAS 327062-44-2) is a chemical compound with molecular formula C29H21ClN4OS and molecular weight 508.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(1-benzylindol-3-yl)-N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide
Also Known As: (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide, (2E)-3-(1-benzyl-1H-indol-3-yl)-N-[5-(3-chlorobenzyl)-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide, (2E)-N-{5-[(3-chlorophenyl)methyl](1,3-thiazol-2-yl)}-2-cyano-3-[1-benzylindol -3-yl]prop-2-enamide, (E)-3-(1-benzylindol-3-yl)-N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide, 3-(1-benzylindol-3-yl)-N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyano-prop-2-enamide
| Molecular Formula | C29H21ClN4OS |
|---|---|
| Molecular Weight | 508.11 g/mol |
| LogP | 6.93598 |
| Topological Polar Surface Area | 70.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 508.11246 |
| Heavy Atoms | 36 |
| Complexity | 1611.3707 |
Chemical Identifiers
| CAS Number | 327062-44-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)/C=C(\C#N)/C(=O)NC4=NC=C(S4)CC5=CC(=CC=C5)Cl |
Product Overview
(e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide (CAS 327062-44-2), with molecular formula C29H21ClN4OS and molecular weight 508.11 g/mol. IUPAC: (E)-3-(1-benzylindol-3-yl)-N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide.
Chemical Property Profile of (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide
Property Insights of (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide
The XLogP value of 6.93598 indicates that (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide 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)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide. Following Lipinski's Rule of Five, (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide 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)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide?
The CAS number of (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide is 327062-44-2.
What is the molecular formula of (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide?
The molecular formula of (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide is C29H21ClN4OS.
What is the molecular weight of (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide?
The molecular weight of (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide is 508.11 g/mol.
Where can I buy (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide?
You can request a quote for (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide 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)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide?
Yes, KEHONG BIO provides custom synthesis services for (e)-3-(1-benzyl-1h-indol-3-yl)-n-(5-(3-chlorobenzyl)thiazol-2-yl)-2-cyanoacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.