N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide
TL;DR: N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide (CAS 681446-63-9) is a chemical compound with molecular formula C21H18N4O and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzotriazol-1-ylmethyl)-N-benzylbenzamide
Also Known As: starbld0003236, N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide, N-(benzotriazol-1-ylmethyl)-N-benzylbenzamide, N-(benzotriazol-1-ylmethyl)-N-benzyl-benzamide, N-((1H-Benzo[d][1,2,3]triazol-1-yl)methyl)-N-benzylbenzamide
| Molecular Formula | C21H18N4O |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 3.7314 |
| Topological Polar Surface Area | 51.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.14807 |
| Heavy Atoms | 26 |
| Complexity | 1011.8225 |
Chemical Identifiers
| CAS Number | 681446-63-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CN2C3=CC=CC=C3N=N2)C(=O)C4=CC=CC=C4 |
Product Overview
N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide (CAS 681446-63-9), with molecular formula C21H18N4O and molecular weight 342.15 g/mol. IUPAC: N-(benzotriazol-1-ylmethyl)-N-benzylbenzamide.
Chemical Property Profile of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide
Property Insights of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide
The XLogP value of 3.7314 indicates that N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.02 Ų, N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide 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-benzylbenzamide 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-benzylbenzamide?
The CAS number of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide is 681446-63-9.
What is the molecular formula of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide?
The molecular formula of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide is C21H18N4O.
What is the molecular weight of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide?
The molecular weight of N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide is 342.15 g/mol.
Where can I buy N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide?
You can request a quote for N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide 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-benzylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-1,2,3-Benzotriazol-1-ylmethyl)-N-benzylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.