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N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
TL;DR: N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide (CAS 428834-79-1) is a chemical compound with molecular formula C17H14N2O3S and molecular weight 326.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: J2.489.500I, N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide, 1-(Benzofuran-2-ylcarbonyl)-3-(4-methoxyphenyl)thiourea, 3-(1-BENZOFURAN-2-CARBONYL)-1-(4-METHOXYPHENYL)THIOUREA, N-((4-methoxyphenyl)carbamothioyl)benzofuran-2-carboxamide
| Molecular Formula | C17H14N2O3S |
|---|---|
| Molecular Weight | 326.07 g/mol |
| LogP | 3.5682 |
| Topological Polar Surface Area | 63.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.0725 |
| Heavy Atoms | 23 |
| Complexity | 822.6608 |
Chemical Identifiers
| CAS Number | 428834-79-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2 |
Product Overview
N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide (CAS 428834-79-1), with molecular formula C17H14N2O3S and molecular weight 326.07 g/mol. IUPAC: N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
Property Insights of N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
The XLogP value of 3.5682 indicates that N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide. Following Lipinski's Rule of Five, N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide has 2 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-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
The CAS number of N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide is 428834-79-1.
What is the molecular formula of N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular formula of N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide is C17H14N2O3S.
What is the molecular weight of N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular weight of N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide is 326.07 g/mol.
Where can I buy N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
You can request a quote for N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-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-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.