Vitamin K semiquinone radical
TL;DR: Vitamin K semiquinone radical (CAS 27689-70-9) is a chemical compound with molecular formula C25H30N2O4 and molecular weight 422.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-aminobenzoic acid;3-[1-hydroxy-2-[(2-methyl-1-phenylpropan-2-yl)amino]ethyl]phenol
Also Known As: Vitamin K semiquinone radical, TV 399, Benzoic acid, 4-amino-, compd. with alpha-(((1,1-dimethyl-2-phenylethyl)amino)methyl)-3-hydroxybenzenemethanol (1:1), 4-Aminobenzoic acid: 3-[1-hydroxy-2-[(2-methyl-1-phenylpropan-2-yl)amino]ethyl]phenol, 4-aminobenzoic acid; 3-[1-hydroxy-2-[(2-methyl-1-phenylpropan-2-yl)amino]ethyl]phenol
| Molecular Formula | C25H30N2O4 |
|---|---|
| Molecular Weight | 422.22 g/mol |
| LogP | 4.0035 |
| Topological Polar Surface Area | 115.81 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.22055 |
| Heavy Atoms | 31 |
| Complexity | 956.7707 |
Chemical Identifiers
| CAS Number | 27689-70-9 |
|---|---|
| SMILES | CC(C)(CC1=CC=CC=C1)NCC(C2=CC(=CC=C2)O)O.C1=CC(=CC=C1C(=O)O)N |
Product Overview
Vitamin K semiquinone radical (CAS 27689-70-9), with molecular formula C25H30N2O4 and molecular weight 422.22 g/mol. IUPAC: 4-aminobenzoic acid;3-[1-hydroxy-2-[(2-methyl-1-phenylpropan-2-yl)amino]ethyl]phenol.
Chemical Property Profile of Vitamin K semiquinone radical
Property Insights of Vitamin K semiquinone radical
The XLogP value of 4.0035 indicates that Vitamin K semiquinone radical is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.81 Ų falls within the moderate polarity range, balancing permeability and solubility for Vitamin K semiquinone radical. Following Lipinski's Rule of Five, Vitamin K semiquinone radical has 5 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 Vitamin K semiquinone radical?
The CAS number of Vitamin K semiquinone radical is 27689-70-9.
What is the molecular formula of Vitamin K semiquinone radical?
The molecular formula of Vitamin K semiquinone radical is C25H30N2O4.
What is the molecular weight of Vitamin K semiquinone radical?
The molecular weight of Vitamin K semiquinone radical is 422.22 g/mol.
Where can I buy Vitamin K semiquinone radical?
You can request a quote for Vitamin K semiquinone radical directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vitamin K semiquinone radical?
Yes, KEHONG BIO provides custom synthesis services for Vitamin K semiquinone radical and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.