Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide
TL;DR: Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide (CAS 1164469-66-2) is a chemical compound with molecular formula C16H18N2O3S and molecular weight 318.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-(tert-butylamino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide
Also Known As: BAS 01128378, Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide, N-[1-[(tert-butylamino)carbonyl]-2-(2-furyl)vinyl]-2-thiophenecarboxamide, (E)-N-(3-(tert-butylamino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl)thiophene-2-carboxamide, N-[(E)-3-(tert-butylamino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide
| Molecular Formula | C16H18N2O3S |
|---|---|
| Molecular Weight | 318.10 g/mol |
| LogP | 3.0267 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 318.10382 |
| Heavy Atoms | 22 |
| Complexity | 664.8193 |
Chemical Identifiers
| CAS Number | 1164469-66-2 |
|---|---|
| SMILES | CC(C)(C)NC(=O)/C(=C\C1=CC=CO1)/NC(=O)C2=CC=CS2 |
Product Overview
Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide (CAS 1164469-66-2), with molecular formula C16H18N2O3S and molecular weight 318.10 g/mol. IUPAC: N-[(E)-3-(tert-butylamino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide.
Chemical Property Profile of Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide
Property Insights of Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide
The XLogP value of 3.0267 indicates that Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide. Following Lipinski's Rule of Five, Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide 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 Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide?
The CAS number of Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide is 1164469-66-2.
What is the molecular formula of Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide?
The molecular formula of Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide is C16H18N2O3S.
What is the molecular weight of Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide?
The molecular weight of Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide is 318.10 g/mol.
Where can I buy Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide?
You can request a quote for Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide?
Yes, KEHONG BIO provides custom synthesis services for Thiophene-2-carboxylic acid (1-tert-butylcarbamoyl-2-furan-2-yl-vinyl)-amide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.