RefChem:1056731
TL;DR: RefChem:1056731 (CAS 26674-44-2) is a chemical compound with molecular formula C14H18BrClN4O4 and molecular weight 420.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[(Z)-2-bromo-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]-2-piperidin-1-ylacetamide;hydrochloride
Also Known As: 1-Piperidineacetic acid, (2-bromo-3-(5-nitro-2-furyl)allylidene)hydrazide, monohydrochloride, 3-(5'-Nitro-2'-furyl)-2-bromo-prop-2-en-1-al (piperidino-acetyl)hydrazone hydrochloride, RefChem:1056731
| Molecular Formula | C14H18BrClN4O4 |
|---|---|
| Molecular Weight | 420.02 g/mol |
| LogP | 2.9333 |
| Topological Polar Surface Area | 100.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.02 |
| Heavy Atoms | 24 |
| Complexity | 626.04553 |
Chemical Identifiers
| CAS Number | 26674-44-2 |
|---|---|
| SMILES | C1CCN(CC1)CC(=O)N/N=C/C(=C/C2=CC=C(O2)[N+](=O)[O-])/Br.Cl |
Product Overview
RefChem:1056731 (CAS 26674-44-2), with molecular formula C14H18BrClN4O4 and molecular weight 420.02 g/mol. IUPAC: N-[(E)-[(Z)-2-bromo-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]-2-piperidin-1-ylacetamide;hydrochloride.
Chemical Property Profile of RefChem:1056731
Property Insights of RefChem:1056731
The XLogP value of 2.9333 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056731. The TPSA of 100.98 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1056731. Following Lipinski's Rule of Five, RefChem:1056731 has 1 hydrogen bond donor(s) and 6 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 RefChem:1056731?
The CAS number of RefChem:1056731 is 26674-44-2.
What is the molecular formula of RefChem:1056731?
The molecular formula of RefChem:1056731 is C14H18BrClN4O4.
What is the molecular weight of RefChem:1056731?
The molecular weight of RefChem:1056731 is 420.02 g/mol.
Where can I buy RefChem:1056731?
You can request a quote for RefChem:1056731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056731?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.