N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide
TL;DR: N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide (CAS 1164560-29-5) is a chemical compound with molecular formula C20H20N4O2S and molecular weight 380.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-(3-imidazol-1-ylpropylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide
Also Known As: N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide, N-[(E)-3-(3-imidazol-1-ylpropylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide, (E)-N-(3-((3-(1H-imidazol-1-yl)propyl)amino)-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl)benzamide, N-[(1E)-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]benzamide
| Molecular Formula | C20H20N4O2S |
|---|---|
| Molecular Weight | 380.13 g/mol |
| LogP | 2.922 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 380.1307 |
| Heavy Atoms | 27 |
| Complexity | 887.48663 |
Chemical Identifiers
| CAS Number | 1164560-29-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CS2)/C(=O)NCCCN3C=CN=C3 |
Product Overview
N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide (CAS 1164560-29-5), with molecular formula C20H20N4O2S and molecular weight 380.13 g/mol. IUPAC: N-[(E)-3-(3-imidazol-1-ylpropylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide.
Chemical Property Profile of N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide
Property Insights of N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide
The XLogP value of 2.922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide. Following Lipinski's Rule of Five, N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide has 2 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-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide?
The CAS number of N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide is 1164560-29-5.
What is the molecular formula of N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide?
The molecular formula of N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide is C20H20N4O2S.
What is the molecular weight of N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide?
The molecular weight of N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide is 380.13 g/mol.
Where can I buy N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide?
You can request a quote for N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-1-(3-Imidazol-1-yl-propylcarbamoyl)-2-thiophen-2-yl-vinyl]-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.