N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
TL;DR: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide (CAS 1001630-69-8) is a chemical compound with molecular formula C18H18N4O4 and molecular weight 354.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
Also Known As: EiM08-06612, N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide, N-(3,4-dimethoxybenzyl)-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide, N-(3,4-dimethoxybenzyl)-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamide, N-[(3,4-DIMETHOXYPHENYL)METHYL]-2-(4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZIN-3-YL)ACETAMIDE
| Molecular Formula | C18H18N4O4 |
|---|---|
| Molecular Weight | 354.13 g/mol |
| LogP | 1.1251 |
| Topological Polar Surface Area | 95.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.1328 |
| Heavy Atoms | 26 |
| Complexity | 999.8928 |
Chemical Identifiers
| CAS Number | 1001630-69-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CNC(=O)CN2C(=O)C3=CC=CC=C3N=N2)OC |
Product Overview
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide (CAS 1001630-69-8), with molecular formula C18H18N4O4 and molecular weight 354.13 g/mol. IUPAC: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide.
Chemical Property Profile of N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
Property Insights of N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
The XLogP value of 1.1251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide. The TPSA of 95.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide. Following Lipinski's Rule of Five, N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide has 1 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-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?
The CAS number of N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide is 1001630-69-8.
What is the molecular formula of N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?
The molecular formula of N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide is C18H18N4O4.
What is the molecular weight of N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?
The molecular weight of N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide is 354.13 g/mol.
Where can I buy N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?
You can request a quote for N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.