![N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide structure](/static/products/111/1111610-07-1.png)
N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide
TL;DR: N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide (CAS 1111610-07-1) is a chemical compound with molecular formula C17H16ClN3OS and molecular weight 345.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide
Also Known As: N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide, (E)-N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide
| Molecular Formula | C17H16ClN3OS |
|---|---|
| Molecular Weight | 345.07 g/mol |
| LogP | 4.28678 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.07025 |
| Heavy Atoms | 23 |
| Complexity | 743.94415 |
Chemical Identifiers
| CAS Number | 1111610-07-1 |
|---|---|
| SMILES | CCCCNC(=O)/C(=C/C1=CSC(=N1)C2=CC=C(C=C2)Cl)/C#N |
Product Overview
N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide (CAS 1111610-07-1), with molecular formula C17H16ClN3OS and molecular weight 345.07 g/mol. IUPAC: (E)-N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide.
Chemical Property Profile of N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide
Property Insights of N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide
The XLogP value of 4.28678 indicates that N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-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-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide. Following Lipinski's Rule of Five, N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-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-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide?
The CAS number of N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide is 1111610-07-1.
What is the molecular formula of N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide?
The molecular formula of N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide is C17H16ClN3OS.
What is the molecular weight of N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide?
The molecular weight of N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide is 345.07 g/mol.
Where can I buy N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide?
You can request a quote for N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-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-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-cyanoprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.