N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide
TL;DR: N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide (CAS 216774-40-2) is a chemical compound with molecular formula C16H16N4O4 and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2H-benzotriazol-5-yl)-3,4,5-trimethoxybenzamide
Also Known As: N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide, N-(1H-Benzotriazol-6-yl)-3,4,5-trimethoxybenzamide, N-(2H-benzotriazol-5-yl)-3,4,5-trimethoxy-benzamide, N-(2H-benzotriazol-5-yl)-3,4,5-trimethoxybenzamide
| Molecular Formula | C16H16N4O4 |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 2.236 |
| Topological Polar Surface Area | 98.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.11716 |
| Heavy Atoms | 24 |
| Complexity | 865.66486 |
Chemical Identifiers
| CAS Number | 216774-40-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC3=NNN=C3C=C2 |
Product Overview
N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide (CAS 216774-40-2), with molecular formula C16H16N4O4 and molecular weight 328.12 g/mol. IUPAC: N-(2H-benzotriazol-5-yl)-3,4,5-trimethoxybenzamide.
Chemical Property Profile of N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide
Property Insights of N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide
The XLogP value of 2.236 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide. The TPSA of 98.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide. Following Lipinski's Rule of Five, N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide has 2 hydrogen bond donor(s) and 6 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-6-yl-3,4,5-trimethoxybenzamide?
The CAS number of N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide is 216774-40-2.
What is the molecular formula of N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide?
The molecular formula of N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide is C16H16N4O4.
What is the molecular weight of N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide?
The molecular weight of N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide is 328.12 g/mol.
Where can I buy N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide?
You can request a quote for N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide 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-6-yl-3,4,5-trimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-1H-Benzotriazol-6-yl-3,4,5-trimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.