![2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide structure](/static/products/314/314766-67-1.png)
2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide
TL;DR: 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide (CAS 314766-67-1) is a chemical compound with molecular formula C14H14FN3OS2 and molecular weight 323.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-fluorophenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxamide
Also Known As: AN-329/40396888, 2-{[(4-fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide, 2-[(4-fluorophenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxamide, 2-({[(4-fluorophenyl)amino]carbonothioyl}amino)-4,5-dimethyl-3-thiophenecarboxamide, 2-[(4-fluorophenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide
| Molecular Formula | C14H14FN3OS2 |
|---|---|
| Molecular Weight | 323.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.05624 |
| Heavy Atoms | 21 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 314766-67-1 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)N)NC(=S)NC2=CC=C(C=C2)F)C |
| InChIKey | JOOGTKXESXSLHK-UHFFFAOYSA-N |
Product Overview
2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide (CAS 314766-67-1), with molecular formula C14H14FN3OS2 and molecular weight 323.06 g/mol. IUPAC: 2-[(4-fluorophenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxamide.
Chemical Property Profile of 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide
Property Insights of 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide
The XLogP value of 3.4 indicates that 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide. Following Lipinski's Rule of Five, 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide has 3 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 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide?
The CAS number of 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide is 314766-67-1.
What is the molecular formula of 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide?
The molecular formula of 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide is C14H14FN3OS2.
What is the molecular weight of 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide?
The molecular weight of 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide is 323.06 g/mol.
Where can I buy 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide?
You can request a quote for 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(4-Fluoroanilino)carbothioyl]amino}-4,5-dimethylthiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.