![3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile structure](/static/products/3770/377059-69-3.webp)
3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
TL;DR: 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile (CAS 377059-69-3) is a chemical compound with molecular formula C22H15N5O2S and molecular weight 413.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile, alpha-[[(2-Methyl-8-quinolinyl)amino]methylene]-4-(4-nitrophenyl)-2-thiazoleacetonitrile, I+/--[[(2-Methyl-8-quinolinyl)amino]methylene]-4-(4-nitrophenyl)-2-thiazoleacetonitrile
| Molecular Formula | C22H15N5O2S |
|---|---|
| Molecular Weight | 413.09 g/mol |
| LogP | 5.5515 |
| Topological Polar Surface Area | 104.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.09464 |
| Heavy Atoms | 30 |
| Complexity | 1319.618 |
Chemical Identifiers
| CAS Number | 377059-69-3 |
|---|---|
| SMILES | CC1=NC2=C(C=CC=C2NC=C(C#N)C3=NC(=CS3)C4=CC=C(C=C4)[N+](=O)[O-])C=C1 |
Product Overview
3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile (CAS 377059-69-3), with molecular formula C22H15N5O2S and molecular weight 413.09 g/mol. IUPAC: 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Property Insights of 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
The XLogP value of 5.5515 indicates that 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile. Following Lipinski's Rule of Five, 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-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 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile?
The CAS number of 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile is 377059-69-3.
What is the molecular formula of 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile?
The molecular formula of 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile is C22H15N5O2S.
What is the molecular weight of 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile?
The molecular weight of 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile is 413.09 g/mol.
Where can I buy 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile?
You can request a quote for 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-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 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.