N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide
TL;DR: N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide (CAS 476309-32-7) is a chemical compound with molecular formula C15H8F2N2O3S and molecular weight 334.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide
Also Known As: N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide, N-(2,4-difluorophenyl)-5-nitrobenzo[b]thiophene-2-carboxamide, F0447-0005
| Molecular Formula | C15H8F2N2O3S |
|---|---|
| Molecular Weight | 334.02 g/mol |
| LogP | 4.34 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.02237 |
| Heavy Atoms | 23 |
| Complexity | 939.61676 |
Chemical Identifiers
| CAS Number | 476309-32-7 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C=C(S2)C(=O)NC3=C(C=C(C=C3)F)F |
Product Overview
N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide (CAS 476309-32-7), with molecular formula C15H8F2N2O3S and molecular weight 334.02 g/mol. IUPAC: N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide.
Chemical Property Profile of N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide
Property Insights of N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide
The XLogP value of 4.34 indicates that N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide. Following Lipinski's Rule of Five, N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-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 N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide?
The CAS number of N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide is 476309-32-7.
What is the molecular formula of N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide?
The molecular formula of N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide is C15H8F2N2O3S.
What is the molecular weight of N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide?
The molecular weight of N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide is 334.02 g/mol.
Where can I buy N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide?
You can request a quote for N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-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-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-difluorophenyl)-5-nitro-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.