![N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide structure](/static/products/4296/429622-87-7.webp)
N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide
TL;DR: N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide (CAS 429622-87-7) is a chemical compound with molecular formula C23H14BrN3O3S and molecular weight 490.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide, 1-(1-BENZOFURAN-2-CARBONYL)-3-[2-(2-BROMOPHENYL)-1,3-BENZOXAZOL-5-YL]THIOUREA, N-((2-(2-bromophenyl)benzo[d]oxazol-5-yl)carbamothioyl)benzofuran-2-carboxamide, N-[[2-(2-bromophenyl)benzooxazol-5-yl]thiocarbamoyl]benzofuran-2-carboxamide, N-{[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
| Molecular Formula | C23H14BrN3O3S |
|---|---|
| Molecular Weight | 490.99 g/mol |
| LogP | 6.1303 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 490.99393 |
| Heavy Atoms | 31 |
| Complexity | 1424.0586 |
Chemical Identifiers
| CAS Number | 429622-87-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=CC=CC=C5Br |
Product Overview
N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide (CAS 429622-87-7), with molecular formula C23H14BrN3O3S and molecular weight 490.99 g/mol. IUPAC: N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide
Property Insights of N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide
The XLogP value of 6.1303 indicates that N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide. Following Lipinski's Rule of Five, N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide?
The CAS number of N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide is 429622-87-7.
What is the molecular formula of N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular formula of N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide is C23H14BrN3O3S.
What is the molecular weight of N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular weight of N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide is 490.99 g/mol.
Where can I buy N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide?
You can request a quote for N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]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-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.