4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide
TL;DR: 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide (CAS 54968-39-7) is a chemical compound with molecular formula C17H16N2OS and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide
Also Known As: 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide
| Molecular Formula | C17H16N2OS |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.09833 |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 54968-39-7 |
|---|---|
| SMILES | C1C(=C(CS1)NC2=CC=CC=C2)C(=O)NC3=CC=CC=C3 |
| InChIKey | XWPDPLDAULKTLE-UHFFFAOYSA-N |
Product Overview
4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide (CAS 54968-39-7), with molecular formula C17H16N2OS and molecular weight 296.10 g/mol. IUPAC: 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide.
Chemical Property Profile of 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide
Property Insights of 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide
The XLogP value of 3.5 indicates that 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide. Following Lipinski's Rule of Five, 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide has 2 hydrogen bond donor(s) and 3 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 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide?
The CAS number of 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide is 54968-39-7.
What is the molecular formula of 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide?
The molecular formula of 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide is C17H16N2OS.
What is the molecular weight of 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide?
The molecular weight of 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide is 296.10 g/mol.
Where can I buy 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide?
You can request a quote for 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-anilino-N-phenyl-2,5-dihydrothiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.