N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide
TL;DR: N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide (CAS 727679-97-2) is a chemical compound with molecular formula C15H13N3O4 and molecular weight 299.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide
Also Known As: N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide, A3779/0160398, N-(benzo[c][1,2,5]oxadiazol-4-yl)-3,4-dimethoxybenzamide
| Molecular Formula | C15H13N3O4 |
|---|---|
| Molecular Weight | 299.09 g/mol |
| LogP | 2.4923 |
| Topological Polar Surface Area | 86.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.0906 |
| Heavy Atoms | 22 |
| Complexity | 828.52057 |
Chemical Identifiers
| CAS Number | 727679-97-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC2=CC=CC3=NON=C32)OC |
Product Overview
N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide (CAS 727679-97-2), with molecular formula C15H13N3O4 and molecular weight 299.09 g/mol. IUPAC: N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide.
Chemical Property Profile of N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide
Property Insights of N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide
The XLogP value of 2.4923 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide. The TPSA of 86.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide. Following Lipinski's Rule of Five, N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide 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-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide?
The CAS number of N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide is 727679-97-2.
What is the molecular formula of N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide?
The molecular formula of N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide is C15H13N3O4.
What is the molecular weight of N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide?
The molecular weight of N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide is 299.09 g/mol.
Where can I buy N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide?
You can request a quote for N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,1,3-benzoxadiazol-4-yl)-3,4-dimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.