1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea
TL;DR: 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea (CAS 67801-35-8) is a chemical compound with molecular formula C13H11BrN4O2 and molecular weight 334.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-3-(pyridine-4-carbonylamino)urea
Also Known As: Isoniazid analog, 1-(4-bromophenyl)-3-(pyridine-4-carbonylamino)urea, N-(4-Bromophenyl)-2-isonicotinoylhydrazine carboxamide, N-(4-Bromophenyl)-2-isonicotinoylhydrazinecarboxamide, n-(4-bromophenyl)-2-(pyridin-4-ylcarbonyl)hydrazinecarboxamide
| Molecular Formula | C13H11BrN4O2 |
|---|---|
| Molecular Weight | 334.01 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 334.00653 |
| Heavy Atoms | 20 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 67801-35-8 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NNC(=O)C2=CC=NC=C2)Br |
| InChIKey | HLDQXCGOODMIFO-UHFFFAOYSA-N |
Product Overview
1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea (CAS 67801-35-8), with molecular formula C13H11BrN4O2 and molecular weight 334.01 g/mol. IUPAC: 1-(4-bromophenyl)-3-(pyridine-4-carbonylamino)urea.
Chemical Property Profile of 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea
Property Insights of 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea has 3 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 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea?
The CAS number of 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea is 67801-35-8.
What is the molecular formula of 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea?
The molecular formula of 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea is C13H11BrN4O2.
What is the molecular weight of 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea?
The molecular weight of 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea is 334.01 g/mol.
Where can I buy 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea?
You can request a quote for 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenyl)-3-(pyridine-4-carbonylamino)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.