(2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid
TL;DR: (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid (CAS 765285-35-6) is a chemical compound with molecular formula C19H19N5O3 and molecular weight 365.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(E)-[3-[4-(dimethylamino)phenyl]-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid
Also Known As: (2-(((3-(4-(DIMETHYLAMINO)PH)-4H-1,2,4-TRIAZOL-4-YL)IMINO)ME)PHENOXY)ACETIC ACID, 2-(2-(((3-(4-(Dimethylamino)phenyl)-4H-1,2,4-triazol-4-yl)imino)methyl)phenoxy)acetic acid, 2-[2-[[3-(4-dimethylaminophenyl)-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic Acid, 643-777-7, RefChem:394729
| Molecular Formula | C19H19N5O3 |
|---|---|
| Molecular Weight | 365.15 g/mol |
| LogP | 2.3567 |
| Topological Polar Surface Area | 92.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 365.1488 |
| Heavy Atoms | 27 |
| Complexity | 947.9888 |
Chemical Identifiers
| CAS Number | 765285-35-6 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2=NN=CN2/N=C/C3=CC=CC=C3OCC(=O)O |
Product Overview
(2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid (CAS 765285-35-6), with molecular formula C19H19N5O3 and molecular weight 365.15 g/mol. IUPAC: 2-[2-[(E)-[3-[4-(dimethylamino)phenyl]-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid.
Chemical Property Profile of (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid
Property Insights of (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid
The XLogP value of 2.3567 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid. The TPSA of 92.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid. Following Lipinski's Rule of Five, (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid 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 (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid?
The CAS number of (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid is 765285-35-6.
What is the molecular formula of (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid?
The molecular formula of (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid is C19H19N5O3.
What is the molecular weight of (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid?
The molecular weight of (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid is 365.15 g/mol.
Where can I buy (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid?
You can request a quote for (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2-(((3-(4-(Dimethylamino)PH)-4H-1,2,4-triazol-4-YL)imino)ME)phenoxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.