Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine
TL;DR: Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine (CAS 111184-83-9) is a chemical compound with molecular formula C21H19N7 and molecular weight 369.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(benzotriazol-1-ylmethyl)-1-phenylmethanamine
Also Known As: Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine, J1.025.820K, AB00074933-01, N,N-bis(benzotriazol-1-ylmethyl)-1-phenylmethanamine, AE-018/31856063
| Molecular Formula | C21H19N7 |
|---|---|
| Molecular Weight | 369.17 g/mol |
| LogP | 3.2934 |
| Topological Polar Surface Area | 64.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.1702 |
| Heavy Atoms | 28 |
| Complexity | 1133.1259 |
Chemical Identifiers
| CAS Number | 111184-83-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CN2C3=CC=CC=C3N=N2)CN4C5=CC=CC=C5N=N4 |
Product Overview
Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine (CAS 111184-83-9), with molecular formula C21H19N7 and molecular weight 369.17 g/mol. IUPAC: N,N-bis(benzotriazol-1-ylmethyl)-1-phenylmethanamine.
Chemical Property Profile of Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine
Property Insights of Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine
The XLogP value of 3.2934 indicates that Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine. Following Lipinski's Rule of Five, Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine has 0 hydrogen bond donor(s) and 5 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 Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine?
The CAS number of Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine is 111184-83-9.
What is the molecular formula of Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine?
The molecular formula of Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine is C21H19N7.
What is the molecular weight of Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine?
The molecular weight of Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine is 369.17 g/mol.
Where can I buy Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine?
You can request a quote for Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine?
Yes, KEHONG BIO provides custom synthesis services for Bis(1H-1,2,3-benzotriazol-1-ylmethyl)(benzyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.