3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide
TL;DR: 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide (CAS 76765-34-9) is a chemical compound with molecular formula C14H22N4O and molecular weight 262.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylaminodiazenyl)-4-methyl-N-(2-methylpropyl)benzamide
Also Known As: 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide, p-Toluamide, 3-(3,3-dimethyltriazeno)-N-isobutyl-, 3-(dimethylaminodiazenyl)-4-methyl-N-(2-methylpropyl)benzamide, Benzamide, 3-(3,3-dimethyl-1-triazenyl)-4-methyl-N-(2-methylpropyl)-, 3-[(1E)-3,3-Dimethyl-1-triazen-1-yl]-N-isobutyl-4-methylbenzamide
| Molecular Formula | C14H22N4O |
|---|---|
| Molecular Weight | 262.18 g/mol |
| LogP | 2.94112 |
| Topological Polar Surface Area | 57.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.17935 |
| Heavy Atoms | 19 |
| Complexity | 466.51382 |
Chemical Identifiers
| CAS Number | 76765-34-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NCC(C)C)N=NN(C)C |
Product Overview
3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide (CAS 76765-34-9), with molecular formula C14H22N4O and molecular weight 262.18 g/mol. IUPAC: 3-(dimethylaminodiazenyl)-4-methyl-N-(2-methylpropyl)benzamide.
Chemical Property Profile of 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide
Property Insights of 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide
The XLogP value of 2.94112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide. With a topological polar surface area (TPSA) of 57.06 Ų, 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide has 1 hydrogen bond donor(s) and 3 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 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide?
The CAS number of 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide is 76765-34-9.
What is the molecular formula of 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide?
The molecular formula of 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide is C14H22N4O.
What is the molecular weight of 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide?
The molecular weight of 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide is 262.18 g/mol.
Where can I buy 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide?
You can request a quote for 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,3-Dimethyltriazeno)-N-isobutyl-p-toluamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.