N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide
TL;DR: N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide (CAS 302804-50-8) is a chemical compound with molecular formula C12H9F2NOS2 and molecular weight 285.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(difluoromethylsulfanyl)phenyl]thiophene-2-carboxamide
Also Known As: BAS 03571468, N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide, N-[4-(difluoromethylthio)phenyl]-2-thienylcarboxamide, N-[4-(difluoromethylsulfanyl)phenyl]thiophene-2-carboxamide, N-(4-((DIFLUOROMETHYL)THIO)PHENYL)-2-THIOPHENECARBOXAMIDE
| Molecular Formula | C12H9F2NOS2 |
|---|---|
| Molecular Weight | 285.01 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.00937 |
| Heavy Atoms | 18 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 302804-50-8 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)NC2=CC=C(C=C2)SC(F)F |
| InChIKey | CXZXVWWYLIMKCW-UHFFFAOYSA-N |
Product Overview
N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide (CAS 302804-50-8), with molecular formula C12H9F2NOS2 and molecular weight 285.01 g/mol. IUPAC: N-[4-(difluoromethylsulfanyl)phenyl]thiophene-2-carboxamide.
Chemical Property Profile of N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide
Property Insights of N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide
The XLogP value of 4.2 indicates that N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide. Following Lipinski's Rule of Five, N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide has 1 hydrogen bond donor(s) and 5 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-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide?
The CAS number of N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide is 302804-50-8.
What is the molecular formula of N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide?
The molecular formula of N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide is C12H9F2NOS2.
What is the molecular weight of N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide?
The molecular weight of N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide is 285.01 g/mol.
Where can I buy N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide?
You can request a quote for N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-{4-[(difluoromethyl)sulfanyl]phenyl}thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.