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N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide
TL;DR: N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide (CAS 324057-48-9) is a chemical compound with molecular formula C12H8ClFN2O2S and molecular weight 298.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide
Also Known As: N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide, AB00107690-01
| Molecular Formula | C12H8ClFN2O2S |
|---|---|
| Molecular Weight | 298.00 g/mol |
| LogP | 3.1989 |
| Topological Polar Surface Area | 54.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.9979 |
| Heavy Atoms | 19 |
| Complexity | 616.1969 |
Chemical Identifiers
| CAS Number | 324057-48-9 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl |
Product Overview
N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide (CAS 324057-48-9), with molecular formula C12H8ClFN2O2S and molecular weight 298.00 g/mol. IUPAC: N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide
Property Insights of N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide
The XLogP value of 3.1989 indicates that N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.27 Ų, N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-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 N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide?
The CAS number of N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide is 324057-48-9.
What is the molecular formula of N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide?
The molecular formula of N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide is C12H8ClFN2O2S.
What is the molecular weight of N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide?
The molecular weight of N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide is 298.00 g/mol.
Where can I buy N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide?
You can request a quote for N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-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-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-chloro-4-fluorophenyl)carbamothioyl]furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.