![N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide structure](/static/products/4454/445419-35-2.webp)
N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
TL;DR: N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide (CAS 445419-35-2) is a chemical compound with molecular formula C17H13BrN2O2S and molecular weight 387.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide, AN-465/41166691, N-(1-benzofuran-2-ylcarbonyl)-N'-(4-bromo-3-methylphenyl)thiourea
| Molecular Formula | C17H13BrN2O2S |
|---|---|
| Molecular Weight | 387.99 g/mol |
| LogP | 4.63052 |
| Topological Polar Surface Area | 54.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 387.9881 |
| Heavy Atoms | 23 |
| Complexity | 871.4997 |
Chemical Identifiers
| CAS Number | 445419-35-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2)Br |
Product Overview
N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide (CAS 445419-35-2), with molecular formula C17H13BrN2O2S and molecular weight 387.99 g/mol. IUPAC: N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
Property Insights of N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
The XLogP value of 4.63052 indicates that N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-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-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-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-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
The CAS number of N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide is 445419-35-2.
What is the molecular formula of N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular formula of N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide is C17H13BrN2O2S.
What is the molecular weight of N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular weight of N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide is 387.99 g/mol.
Where can I buy N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
You can request a quote for N-[(4-bromo-3-methylphenyl)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-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-bromo-3-methylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.