5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide
TL;DR: 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide (CAS 957313-19-8) is a chemical compound with molecular formula C11H15N3OS and molecular weight 237.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide
Also Known As: 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide, TimTec1_000404, 4'-Butoxycarbonyloxybenzylidene-4-methoxyaniline, BRD-K09032658-001-01-2, (5-amino-4-cyano-3-methyl(2-thienyl))-N,N-diethylcarboxamide
| Molecular Formula | C11H15N3OS |
|---|---|
| Molecular Weight | 237.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 98.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.09358 |
| Heavy Atoms | 16 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 957313-19-8 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)N)C#N)C |
| InChIKey | HNCPUGCSLAOXGJ-UHFFFAOYSA-N |
Product Overview
5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide (CAS 957313-19-8), with molecular formula C11H15N3OS and molecular weight 237.09 g/mol. IUPAC: 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide.
Chemical Property Profile of 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide
Property Insights of 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide. The TPSA of 98.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide. Following Lipinski's Rule of Five, 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide 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 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide?
The CAS number of 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide is 957313-19-8.
What is the molecular formula of 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide?
The molecular formula of 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide is C11H15N3OS.
What is the molecular weight of 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide?
The molecular weight of 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide is 237.09 g/mol.
Where can I buy 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide?
You can request a quote for 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.