N-(1-benzofuran-5-yl)-N'-benzoylthiourea
TL;DR: N-(1-benzofuran-5-yl)-N'-benzoylthiourea (CAS 866017-44-9) is a chemical compound with molecular formula C16H12N2O2S and molecular weight 296.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-benzofuran-5-ylcarbamothioyl)benzamide
Also Known As: N-(1-benzofuran-5-yl)-N'-benzoylthiourea, 1-benzoyl-3-(1-benzofuran-5-yl)thiourea, N-(1-benzofuran-5-ylcarbamothioyl)benzamide, N-(benzofuran-5-ylcarbamothioyl)benzamide, 4N-076
| Molecular Formula | C16H12N2O2S |
|---|---|
| Molecular Weight | 296.06 g/mol |
| LogP | 3.5596 |
| Topological Polar Surface Area | 54.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.06195 |
| Heavy Atoms | 21 |
| Complexity | 796.1569 |
Chemical Identifiers
| CAS Number | 866017-44-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC=C3 |
Product Overview
N-(1-benzofuran-5-yl)-N'-benzoylthiourea (CAS 866017-44-9), with molecular formula C16H12N2O2S and molecular weight 296.06 g/mol. IUPAC: N-(1-benzofuran-5-ylcarbamothioyl)benzamide.
Chemical Property Profile of N-(1-benzofuran-5-yl)-N'-benzoylthiourea
Property Insights of N-(1-benzofuran-5-yl)-N'-benzoylthiourea
The XLogP value of 3.5596 indicates that N-(1-benzofuran-5-yl)-N'-benzoylthiourea 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-(1-benzofuran-5-yl)-N'-benzoylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-benzofuran-5-yl)-N'-benzoylthiourea 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-(1-benzofuran-5-yl)-N'-benzoylthiourea?
The CAS number of N-(1-benzofuran-5-yl)-N'-benzoylthiourea is 866017-44-9.
What is the molecular formula of N-(1-benzofuran-5-yl)-N'-benzoylthiourea?
The molecular formula of N-(1-benzofuran-5-yl)-N'-benzoylthiourea is C16H12N2O2S.
What is the molecular weight of N-(1-benzofuran-5-yl)-N'-benzoylthiourea?
The molecular weight of N-(1-benzofuran-5-yl)-N'-benzoylthiourea is 296.06 g/mol.
Where can I buy N-(1-benzofuran-5-yl)-N'-benzoylthiourea?
You can request a quote for N-(1-benzofuran-5-yl)-N'-benzoylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-benzofuran-5-yl)-N'-benzoylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(1-benzofuran-5-yl)-N'-benzoylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.