N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline
TL;DR: N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline (CAS 85122-57-2) is a chemical compound with molecular formula C15H16N4 and molecular weight 252.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzotriazol-1-ylmethyl)-3,4-dimethylaniline
Also Known As: N-(benzotriazol-1-ylmethyl)-3,4-dimethylaniline, N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline, N-((1H-benzo[d][1,2,3]triazol-1-yl)methyl)-3,4-dimethylaniline
| Molecular Formula | C15H16N4 |
|---|---|
| Molecular Weight | 252.14 g/mol |
| LogP | 3.11774 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.1375 |
| Heavy Atoms | 19 |
| Complexity | 714.9924 |
Chemical Identifiers
| CAS Number | 85122-57-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NCN2C3=CC=CC=C3N=N2)C |
Product Overview
N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline (CAS 85122-57-2), with molecular formula C15H16N4 and molecular weight 252.14 g/mol. IUPAC: N-(benzotriazol-1-ylmethyl)-3,4-dimethylaniline.
Chemical Property Profile of N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline
Property Insights of N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline
The XLogP value of 3.11774 indicates that N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.74 Ų, N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline 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 N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline?
The CAS number of N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline is 85122-57-2.
What is the molecular formula of N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline?
The molecular formula of N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline is C15H16N4.
What is the molecular weight of N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline?
The molecular weight of N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline is 252.14 g/mol.
Where can I buy N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline?
You can request a quote for N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-benzotriazol-1-ylmethyl)-3,4-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.