Benzoxazole, 2,2'-(1,4-butanediyl)bis-
TL;DR: Benzoxazole, 2,2'-(1,4-butanediyl)bis- (CAS 2013-12-9) is a chemical compound with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1,3-benzoxazol-2-yl)butyl]-1,3-benzoxazole
Also Known As: benzoxazole, 2,2'-(1,4-butanediyl)bis-, NCIOpen2_007072, 2,2'-(1,4-BUTANEDIYL)BIS-1,3-BENZOXAZOLE, 2-[4-(1,3-benzoxazol-2-yl)butyl]-1,3-benzoxazole, 2-(4-benzoxazol-2-ylbutyl)benzoxazole
| Molecular Formula | C18H16N2O2 |
|---|---|
| Molecular Weight | 292.12 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 52.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.1212 |
| Heavy Atoms | 22 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 2013-12-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)CCCCC3=NC4=CC=CC=C4O3 |
| InChIKey | LNGWMLBHQIUQIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoxazole, 2,2'-(1,4-butanediyl)bis- (CAS 2013-12-9), with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol. IUPAC: 2-[4-(1,3-benzoxazol-2-yl)butyl]-1,3-benzoxazole.
Chemical Property Profile of Benzoxazole, 2,2'-(1,4-butanediyl)bis-
Property Insights of Benzoxazole, 2,2'-(1,4-butanediyl)bis-
The XLogP value of 4.6 indicates that Benzoxazole, 2,2'-(1,4-butanediyl)bis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.1 Ų, Benzoxazole, 2,2'-(1,4-butanediyl)bis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoxazole, 2,2'-(1,4-butanediyl)bis- has 0 hydrogen bond donor(s) and 4 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 Benzoxazole, 2,2'-(1,4-butanediyl)bis-?
The CAS number of Benzoxazole, 2,2'-(1,4-butanediyl)bis- is 2013-12-9.
What is the molecular formula of Benzoxazole, 2,2'-(1,4-butanediyl)bis-?
The molecular formula of Benzoxazole, 2,2'-(1,4-butanediyl)bis- is C18H16N2O2.
What is the molecular weight of Benzoxazole, 2,2'-(1,4-butanediyl)bis-?
The molecular weight of Benzoxazole, 2,2'-(1,4-butanediyl)bis- is 292.12 g/mol.
Where can I buy Benzoxazole, 2,2'-(1,4-butanediyl)bis-?
You can request a quote for Benzoxazole, 2,2'-(1,4-butanediyl)bis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoxazole, 2,2'-(1,4-butanediyl)bis-?
Yes, KEHONG BIO provides custom synthesis services for Benzoxazole, 2,2'-(1,4-butanediyl)bis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.