![1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole structure](/static/products/1615/161533-36-4.webp)
1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole
TL;DR: 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole (CAS 161533-36-4) is a chemical compound with molecular formula C16H14N4 and molecular weight 262.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1-methylindol-3-yl)methyl]benzotriazole
Also Known As: 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole, 1-[(1-methylindol-3-yl)methyl]benzotriazole, 1-methyl-3-(benzotriazol-1-ylmethyl)indole, 1-Methyl-3-(1H-benzotriazol-1-ylmethyl)-1H-indole, 1-[(1-methyl-1H-indol-3-yl)-methyl]-1H-benzotriazole
| Molecular Formula | C16H14N4 |
|---|---|
| Molecular Weight | 262.12 g/mol |
| LogP | 2.9713 |
| Topological Polar Surface Area | 35.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.12186 |
| Heavy Atoms | 20 |
| Complexity | 901.03107 |
Chemical Identifiers
| CAS Number | 161533-36-4 |
|---|---|
| SMILES | CN1C=C(C2=CC=CC=C21)CN3C4=CC=CC=C4N=N3 |
Product Overview
1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole (CAS 161533-36-4), with molecular formula C16H14N4 and molecular weight 262.12 g/mol. IUPAC: 1-[(1-methylindol-3-yl)methyl]benzotriazole.
Chemical Property Profile of 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole
Property Insights of 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole
The XLogP value of 2.9713 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole. With a topological polar surface area (TPSA) of 35.64 Ų, 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole has 0 hydrogen bond donor(s) and 2 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-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole?
The CAS number of 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole is 161533-36-4.
What is the molecular formula of 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole?
The molecular formula of 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole is C16H14N4.
What is the molecular weight of 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole?
The molecular weight of 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole is 262.12 g/mol.
Where can I buy 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole?
You can request a quote for 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[(1-methyl-1H-indol-3-yl)methyl]-1H-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.