6-Methyl-2-phenylbenzotriazol-5-amine
TL;DR: 6-Methyl-2-phenylbenzotriazol-5-amine (CAS 82811-23-2) is a chemical compound with molecular formula C13H12N4 and molecular weight 224.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-phenylbenzotriazol-5-amine
Also Known As: starbld0016071, 6-methyl-2-phenylbenzotriazol-5-amine, 6-methyl-2-phenyl-2H-1,2,3-benzotriazol-5-amine, BAS 03847236, 5-amino-6-methyl-2-phenylbenzotriazole
| Molecular Formula | C13H12N4 |
|---|---|
| Molecular Weight | 224.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.1062 |
| Heavy Atoms | 17 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 82811-23-2 |
|---|---|
| SMILES | CC1=CC2=NN(N=C2C=C1N)C3=CC=CC=C3 |
| InChIKey | ITGZELOHCKIVPL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Methyl-2-phenylbenzotriazol-5-amine (CAS 82811-23-2), with molecular formula C13H12N4 and molecular weight 224.11 g/mol. IUPAC: 6-methyl-2-phenylbenzotriazol-5-amine.
Chemical Property Profile of 6-Methyl-2-phenylbenzotriazol-5-amine
Property Insights of 6-Methyl-2-phenylbenzotriazol-5-amine
The XLogP value of 3.0 indicates that 6-Methyl-2-phenylbenzotriazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.7 Ų, 6-Methyl-2-phenylbenzotriazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-2-phenylbenzotriazol-5-amine 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 6-Methyl-2-phenylbenzotriazol-5-amine?
The CAS number of 6-Methyl-2-phenylbenzotriazol-5-amine is 82811-23-2.
What is the molecular formula of 6-Methyl-2-phenylbenzotriazol-5-amine?
The molecular formula of 6-Methyl-2-phenylbenzotriazol-5-amine is C13H12N4.
What is the molecular weight of 6-Methyl-2-phenylbenzotriazol-5-amine?
The molecular weight of 6-Methyl-2-phenylbenzotriazol-5-amine is 224.11 g/mol.
Where can I buy 6-Methyl-2-phenylbenzotriazol-5-amine?
You can request a quote for 6-Methyl-2-phenylbenzotriazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-2-phenylbenzotriazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-2-phenylbenzotriazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.