N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline
TL;DR: N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline (CAS 146041-86-3) is a chemical compound with molecular formula C20H18N4 and molecular weight 314.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzotriazol-1-ylmethyl)-N-benzylaniline
Also Known As: starbld0005986, N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline, N-(benzotriazol-1-ylmethyl)-N-benzylaniline, Benzenamine, N-benzyl-N-(1-benzortiazolylmethyl)-, N-(benzotriazol-1-ylmethyl)-N-benzyl-aniline
| Molecular Formula | C20H18N4 |
|---|---|
| Molecular Weight | 314.15 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.15314 |
| Heavy Atoms | 24 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 146041-86-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CN2C3=CC=CC=C3N=N2)C4=CC=CC=C4 |
| InChIKey | BZOURKQMIPXHGQ-UHFFFAOYSA-N |
Product Overview
N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline (CAS 146041-86-3), with molecular formula C20H18N4 and molecular weight 314.15 g/mol. IUPAC: N-(benzotriazol-1-ylmethyl)-N-benzylaniline.
Chemical Property Profile of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline
Property Insights of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline
The XLogP value of 4.6 indicates that N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.0 Ų, N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline has 0 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-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline?
The CAS number of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline is 146041-86-3.
What is the molecular formula of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline?
The molecular formula of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline is C20H18N4.
What is the molecular weight of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline?
The molecular weight of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline is 314.15 g/mol.
Where can I buy N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline?
You can request a quote for N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.