N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide
TL;DR: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide (CAS 852026-76-7) is a chemical compound with molecular formula C18H19N3OS and molecular weight 325.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide
Also Known As: (E)-N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide, N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide
| Molecular Formula | C18H19N3OS |
|---|---|
| Molecular Weight | 325.12 g/mol |
| LogP | 4.2947 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.12488 |
| Heavy Atoms | 23 |
| Complexity | 773.83344 |
Chemical Identifiers
| CAS Number | 852026-76-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=CS2)C(C)(C)C |
Product Overview
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide (CAS 852026-76-7), with molecular formula C18H19N3OS and molecular weight 325.12 g/mol. IUPAC: (E)-N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide.
Chemical Property Profile of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide
Property Insights of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide
The XLogP value of 4.2947 indicates that N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide. Following Lipinski's Rule of Five, N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide?
The CAS number of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide is 852026-76-7.
What is the molecular formula of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide?
The molecular formula of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide is C18H19N3OS.
What is the molecular weight of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide?
The molecular weight of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide is 325.12 g/mol.
Where can I buy N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide?
You can request a quote for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyano-3-(4-methylphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.