(E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile
TL;DR: (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile (CAS 333414-01-0) is a chemical compound with molecular formula C26H19N3O4S and molecular weight 469.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-methoxy-4-phenylmethoxyphenyl)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile, (2E)-3-[4-(benzyloxy)-3-methoxyphenyl]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile, (E)-3-(3-methoxy-4-phenylmethoxyphenyl)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
| Molecular Formula | C26H19N3O4S |
|---|---|
| Molecular Weight | 469.11 g/mol |
| LogP | 6.37008 |
| Topological Polar Surface Area | 98.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 469.10962 |
| Heavy Atoms | 34 |
| Complexity | 1373.4336 |
Chemical Identifiers
| CAS Number | 333414-01-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])OCC4=CC=CC=C4 |
Product Overview
(E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile (CAS 333414-01-0), with molecular formula C26H19N3O4S and molecular weight 469.11 g/mol. IUPAC: (E)-3-(3-methoxy-4-phenylmethoxyphenyl)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile
Property Insights of (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile
The XLogP value of 6.37008 indicates that (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.28 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile. Following Lipinski's Rule of Five, (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile has 0 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 (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile?
The CAS number of (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile is 333414-01-0.
What is the molecular formula of (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile?
The molecular formula of (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile is C26H19N3O4S.
What is the molecular weight of (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile?
The molecular weight of (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile is 469.11 g/mol.
Where can I buy (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile?
You can request a quote for (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(4-(benzyloxy)-3-methoxyphenyl)-2-(4-(4-nitrophenyl)thiazol-2-yl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.