N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine
TL;DR: N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine (CAS 352647-55-3) is a chemical compound with molecular formula C12H7N5O2 and molecular weight 253.06 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)-2,1,3-benzoxadiazol-4-amine
Also Known As: dibenzo[c]1,2,5-oxadiazol-4-ylamine, Bis-benzo[1,2,5]oxadiazol-4-yl-amine, BAS 00318830, bis(benzo[c][1,2,5]oxadiazol-4-yl)amine, N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine
| Molecular Formula | C12H7N5O2 |
|---|---|
| Molecular Weight | 253.06 g/mol |
| LogP | 2.5026 |
| Topological Polar Surface Area | 89.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.05997 |
| Heavy Atoms | 19 |
| Complexity | 794.4582 |
Chemical Identifiers
| CAS Number | 352647-55-3 |
|---|---|
| SMILES | C1=CC2=NON=C2C(=C1)NC3=CC=CC4=NON=C43 |
Product Overview
N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine (CAS 352647-55-3), with molecular formula C12H7N5O2 and molecular weight 253.06 g/mol. IUPAC: N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine.
Chemical Property Profile of N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine
Property Insights of N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine
The XLogP value of 2.5026 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine. The TPSA of 89.87 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine. Following Lipinski's Rule of Five, N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine has 1 hydrogen bond donor(s) and 7 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)-2,1,3-benzoxadiazol-4-amine?
The CAS number of N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine is 352647-55-3.
What is the molecular formula of N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine?
The molecular formula of N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine is C12H7N5O2.
What is the molecular weight of N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine?
The molecular weight of N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine is 253.06 g/mol.
Where can I buy N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine?
You can request a quote for N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine 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)-2,1,3-benzoxadiazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2,1,3-benzoxadiazol-4-yl)-2,1,3-benzoxadiazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.