![(2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile structure](/static/products/378/378198-37-9.png)
(2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
TL;DR: (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile (CAS 378198-37-9) is a chemical compound with molecular formula C24H24N4O3S and molecular weight 448.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(5-methoxy-2-methyl-4-nitroanilino)-2-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile, (E)-2-(4-(4-isobutylphenyl)thiazol-2-yl)-3-((5-methoxy-2-methyl-4-nitrophenyl)amino)acrylonitrile, (E)-3-(5-methoxy-2-methyl-4-nitroanilino)-2-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]prop-2-enenitrile
| Molecular Formula | C24H24N4O3S |
|---|---|
| Molecular Weight | 448.16 g/mol |
| LogP | 6.2104 |
| Topological Polar Surface Area | 101.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 448.15692 |
| Heavy Atoms | 32 |
| Complexity | 1190.9436 |
Chemical Identifiers
| CAS Number | 378198-37-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N/C=C(\C#N)/C2=NC(=CS2)C3=CC=C(C=C3)CC(C)C)OC)[N+](=O)[O-] |
Product Overview
(2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile (CAS 378198-37-9), with molecular formula C24H24N4O3S and molecular weight 448.16 g/mol. IUPAC: (E)-3-(5-methoxy-2-methyl-4-nitroanilino)-2-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
Property Insights of (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
The XLogP value of 6.2104 indicates that (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.08 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile. Following Lipinski's Rule of Five, (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile?
The CAS number of (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile is 378198-37-9.
What is the molecular formula of (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile?
The molecular formula of (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile is C24H24N4O3S.
What is the molecular weight of (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile?
The molecular weight of (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile is 448.16 g/mol.
Where can I buy (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile?
You can request a quote for (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-[(5-methoxy-2-methyl-4-nitrophenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.