2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol
TL;DR: 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol (CAS 514183-69-8) is a chemical compound with molecular formula C27H37N3O2 and molecular weight 435.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-ditert-butyl-4-[[4-(dimethylamino)phenyl]-[(5-methyl-1,2-oxazol-3-yl)amino]methyl]phenol
Also Known As: 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol, 2,6-di-tert-butyl-4-{[4-(dimethylamino)phenyl][(5-methyl-1,2-oxazol-3-yl)amino]methyl}phenol, 2,6-di-tert-butyl-4-{[p-(dimethylamino)phenyl](5-methyl-3-isoxazolylamino)methyl}phenol, 2,6-bis(tert-butyl)-4-{[4-(dimethylamino)phenyl][(5-methylisoxazol-3-yl)amino] methyl}phenol, 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-[(5-methyl-1,2-oxazol-3-yl)amino]methyl]phenol
| Molecular Formula | C27H37N3O2 |
|---|---|
| Molecular Weight | 435.29 g/mol |
| LogP | 6.55112 |
| Topological Polar Surface Area | 61.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 435.28857 |
| Heavy Atoms | 32 |
| Complexity | 1032.5114 |
Chemical Identifiers
| CAS Number | 514183-69-8 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(C2=CC=C(C=C2)N(C)C)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C |
Product Overview
2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol (CAS 514183-69-8), with molecular formula C27H37N3O2 and molecular weight 435.29 g/mol. IUPAC: 2,6-ditert-butyl-4-[[4-(dimethylamino)phenyl]-[(5-methyl-1,2-oxazol-3-yl)amino]methyl]phenol.
Chemical Property Profile of 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol
Property Insights of 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol
The XLogP value of 6.55112 indicates that 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol. Following Lipinski's Rule of Five, 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol?
The CAS number of 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol is 514183-69-8.
What is the molecular formula of 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol?
The molecular formula of 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol is C27H37N3O2.
What is the molecular weight of 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol?
The molecular weight of 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol is 435.29 g/mol.
Where can I buy 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol?
You can request a quote for 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-di-tert-butyl-4-((4-(dimethylamino)phenyl)((5-methylisoxazol-3-yl)amino)methyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.