![N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide structure](/static/products/6722/672272-07-0.webp)
N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide
TL;DR: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide (CAS 672272-07-0) is a chemical compound with molecular formula C20H19N3O3S and molecular weight 381.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: N-((4-isobutyramidophenyl)carbamothioyl)benzofuran-2-carboxamide, N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide, N'-(1-benzofuran-2-ylcarbonyl)-N-{4-[(2-methylpropanoyl)amino]phenyl}carbamimidothioic acid, N-({[4-(isobutyrylamino)phenyl]amino}carbonothioyl)-1-benzofuran-2-carboxamide
| Molecular Formula | C20H19N3O3S |
|---|---|
| Molecular Weight | 381.11 g/mol |
| LogP | 4.1541 |
| Topological Polar Surface Area | 83.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.11472 |
| Heavy Atoms | 27 |
| Complexity | 960.1344 |
Chemical Identifiers
| CAS Number | 672272-07-0 |
|---|---|
| SMILES | CC(C)C(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2 |
Product Overview
N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide (CAS 672272-07-0), with molecular formula C20H19N3O3S and molecular weight 381.11 g/mol. IUPAC: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide
Property Insights of N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide
The XLogP value of 4.1541 indicates that N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.37 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide. Following Lipinski's Rule of Five, N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-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 N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide?
The CAS number of N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide is 672272-07-0.
What is the molecular formula of N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular formula of N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide is C20H19N3O3S.
What is the molecular weight of N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular weight of N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide is 381.11 g/mol.
Where can I buy N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide?
You can request a quote for N-[[4-(2-methylpropanoylamino)phenyl]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-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.