4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide
TL;DR: 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide (CAS 681015-58-7) is a chemical compound with molecular formula C11H12BrN3O2 and molecular weight 297.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-1-ethyl-N-(furan-2-ylmethyl)pyrazole-3-carboxamide
Also Known As: ChemDiv2_004710, IDI1_003425, 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide, 4-Bromo-1-ethyl-N-(furan-2-ylmethyl)-1H-pyrazole-3-carboxamide, 4-bromo-1-ethyl-N-(furan-2-ylmethyl)pyrazole-3-carboxamide
| Molecular Formula | C11H12BrN3O2 |
|---|---|
| Molecular Weight | 297.01 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 60.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.0113 |
| Heavy Atoms | 17 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 681015-58-7 |
|---|---|
| SMILES | CCN1C=C(C(=N1)C(=O)NCC2=CC=CO2)Br |
| InChIKey | IBWPARCNNQVTLZ-UHFFFAOYSA-N |
Product Overview
4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide (CAS 681015-58-7), with molecular formula C11H12BrN3O2 and molecular weight 297.01 g/mol. IUPAC: 4-bromo-1-ethyl-N-(furan-2-ylmethyl)pyrazole-3-carboxamide.
Chemical Property Profile of 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide
Property Insights of 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide. The TPSA of 60.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide. Following Lipinski's Rule of Five, 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide has 1 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 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide?
The CAS number of 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide is 681015-58-7.
What is the molecular formula of 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide?
The molecular formula of 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide is C11H12BrN3O2.
What is the molecular weight of 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide?
The molecular weight of 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide is 297.01 g/mol.
Where can I buy 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide?
You can request a quote for 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-1-ethyl-N-(2-furylmethyl)-1H-pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.