N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide
TL;DR: N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide (CAS 18336-86-2) is a chemical compound with molecular formula C16H11Br2N3O3 and molecular weight 450.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(4,5-dibromofuran-2-yl)methylideneamino]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Also Known As: N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide, N-[(E)-(4,5-dibromofuran-2-yl)methylideneamino]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide, N-[(E)-(4,5-dibromo-2-furanyl)methylideneamino]-5-methyl-3-phenyl-4-isoxazolecarboxamide, N-[(E)-(4,5-dibromo-2-furyl)methyleneamino]-5-methyl-3-phenyl-isoxazole-4-carboxamide, N-[(E)-[4,5-bis(bromanyl)furan-2-yl]methylideneamino]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
| Molecular Formula | C16H11Br2N3O3 |
|---|---|
| Molecular Weight | 450.92 g/mol |
| LogP | 4.53192 |
| Topological Polar Surface Area | 80.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.91672 |
| Heavy Atoms | 24 |
| Complexity | 881.19086 |
Chemical Identifiers
| CAS Number | 18336-86-2 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N/N=C/C3=CC(=C(O3)Br)Br |
Product Overview
N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide (CAS 18336-86-2), with molecular formula C16H11Br2N3O3 and molecular weight 450.92 g/mol. IUPAC: N-[(E)-(4,5-dibromofuran-2-yl)methylideneamino]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide
Property Insights of N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide
The XLogP value of 4.53192 indicates that N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide. Following Lipinski's Rule of Five, N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide has 1 hydrogen bond donor(s) and 5 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'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide?
The CAS number of N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide is 18336-86-2.
What is the molecular formula of N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide?
The molecular formula of N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide is C16H11Br2N3O3.
What is the molecular weight of N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide?
The molecular weight of N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide is 450.92 g/mol.
Where can I buy N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide?
You can request a quote for N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-[(4,5-dibromo-2-furyl)methylene]-5-methyl-3-phenyl-4-isoxazolecarbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.