Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate
TL;DR: Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate (CAS 73770-79-3) is a chemical compound with molecular formula C20H14N2O3 and molecular weight 330.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate
Also Known As: methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate, AQ-344/43100359
| Molecular Formula | C20H14N2O3 |
|---|---|
| Molecular Weight | 330.10 g/mol |
| LogP | 4.3434 |
| Topological Polar Surface Area | 65.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.10043 |
| Heavy Atoms | 25 |
| Complexity | 1040.6849 |
Chemical Identifiers
| CAS Number | 73770-79-3 |
|---|---|
| SMILES | COC(=O)C1=C(C2=NON=C2C(=C1)C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate (CAS 73770-79-3), with molecular formula C20H14N2O3 and molecular weight 330.10 g/mol. IUPAC: methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate.
Chemical Property Profile of Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate
Property Insights of Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate
The XLogP value of 4.3434 indicates that Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate. Following Lipinski's Rule of Five, Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate 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 Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate?
The CAS number of Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate is 73770-79-3.
What is the molecular formula of Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate?
The molecular formula of Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate is C20H14N2O3.
What is the molecular weight of Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate?
The molecular weight of Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate is 330.10 g/mol.
Where can I buy Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate?
You can request a quote for Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4,7-diphenyl-2,1,3-benzoxadiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.