![6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid structure](/static/products/956/956044-69-2.png)
6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid
TL;DR: 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid (CAS 956044-69-2) is a chemical compound with molecular formula C16H20N4O4 and molecular weight 332.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[(2S)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanoyl]amino]hexanoic acid
Also Known As: 6-[[(2S)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanoyl]amino]hexanoic acid, 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid, 6-{[(2S)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]amino}hexanoic acid, (S)-6-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)propanamido)hexanoic acid, 6-[(S)-2-(4-Oxo-4H-benzo[d][1,2,3]triazin-3-yl)-propionylamino]-hexanoic acid
| Molecular Formula | C16H20N4O4 |
|---|---|
| Molecular Weight | 332.15 g/mol |
| LogP | 1.1137 |
| Topological Polar Surface Area | 114.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 332.14847 |
| Heavy Atoms | 24 |
| Complexity | 786.9862 |
Chemical Identifiers
| CAS Number | 956044-69-2 |
|---|---|
| SMILES | C[C@@H](C(=O)NCCCCCC(=O)O)N1C(=O)C2=CC=CC=C2N=N1 |
Product Overview
6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid (CAS 956044-69-2), with molecular formula C16H20N4O4 and molecular weight 332.15 g/mol. IUPAC: 6-[[(2S)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanoyl]amino]hexanoic acid.
Chemical Property Profile of 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid
Property Insights of 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid
The XLogP value of 1.1137 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid. The TPSA of 114.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid. Following Lipinski's Rule of Five, 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid has 2 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 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid?
The CAS number of 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid is 956044-69-2.
What is the molecular formula of 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid?
The molecular formula of 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid is C16H20N4O4.
What is the molecular weight of 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid?
The molecular weight of 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid is 332.15 g/mol.
Where can I buy 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid?
You can request a quote for 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-[[(2S)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.