![4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid structure](/static/products/899/899384-82-8.png)
4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid
TL;DR: 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid (CAS 899384-82-8) is a chemical compound with molecular formula C18H22N4O4 and molecular weight 358.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid
Also Known As: 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid, 4-[[3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid, 4-({[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}methyl)cyclohexanecarboxylic acid
| Molecular Formula | C18H22N4O4 |
|---|---|
| Molecular Weight | 358.16 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.1641 |
| Heavy Atoms | 26 |
| Complexity | 572.0 |
Chemical Identifiers
| CAS Number | 899384-82-8 |
|---|---|
| SMILES | C1CC(CCC1CNC(=O)CCN2C(=O)C3=CC=CC=C3N=N2)C(=O)O |
| InChIKey | IKLGHGVERJIOAB-UHFFFAOYSA-N |
Product Overview
4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid (CAS 899384-82-8), with molecular formula C18H22N4O4 and molecular weight 358.16 g/mol. IUPAC: 4-[[3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid
Property Insights of 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid. Following Lipinski's Rule of Five, 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid has 2 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 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid?
The CAS number of 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid is 899384-82-8.
What is the molecular formula of 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid?
The molecular formula of 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid is C18H22N4O4.
What is the molecular weight of 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid?
The molecular weight of 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid is 358.16 g/mol.
Where can I buy 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid?
You can request a quote for 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((3-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)methyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.