1-Methyl-1H-1,2,3-benzotriazol-4-amine
TL;DR: 1-Methyl-1H-1,2,3-benzotriazol-4-amine (CAS 27799-82-2) is a chemical compound with molecular formula C7H8N4 and molecular weight 148.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylbenzotriazol-4-amine
Also Known As: 1-Methyl-1H-1,2,3-benzotriazol-4-amine, 1-methylbenzotriazol-4-amine, 1H-Benzotriazole, 4-amino-1-methyl-, 1-methyl-4-benzotriazolamine, 1-Methyl-1H-benzo[d][1,2,3]triazol-4-amine
| Molecular Formula | C7H8N4 |
|---|---|
| Molecular Weight | 148.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.07489 |
| Heavy Atoms | 11 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 27799-82-2 |
|---|---|
| SMILES | CN1C2=CC=CC(=C2N=N1)N |
| InChIKey | YQOPKUFXAXHGRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-1H-1,2,3-benzotriazol-4-amine (CAS 27799-82-2), with molecular formula C7H8N4 and molecular weight 148.07 g/mol. IUPAC: 1-methylbenzotriazol-4-amine.
Chemical Property Profile of 1-Methyl-1H-1,2,3-benzotriazol-4-amine
Property Insights of 1-Methyl-1H-1,2,3-benzotriazol-4-amine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-1H-1,2,3-benzotriazol-4-amine. With a topological polar surface area (TPSA) of 56.7 Ų, 1-Methyl-1H-1,2,3-benzotriazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-1H-1,2,3-benzotriazol-4-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 1-Methyl-1H-1,2,3-benzotriazol-4-amine?
The CAS number of 1-Methyl-1H-1,2,3-benzotriazol-4-amine is 27799-82-2.
What is the molecular formula of 1-Methyl-1H-1,2,3-benzotriazol-4-amine?
The molecular formula of 1-Methyl-1H-1,2,3-benzotriazol-4-amine is C7H8N4.
What is the molecular weight of 1-Methyl-1H-1,2,3-benzotriazol-4-amine?
The molecular weight of 1-Methyl-1H-1,2,3-benzotriazol-4-amine is 148.07 g/mol.
Where can I buy 1-Methyl-1H-1,2,3-benzotriazol-4-amine?
You can request a quote for 1-Methyl-1H-1,2,3-benzotriazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-1H-1,2,3-benzotriazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-1H-1,2,3-benzotriazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.