![1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one structure](/static/products/3994/39949-79-6.webp)
1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one
TL;DR: 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one (CAS 39949-79-6) is a chemical compound with molecular formula C31H23NO4 and molecular weight 473.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,4-bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one
Also Known As: 1-[3,4-bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one, 1-[3,4-bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquino, 1-[3,4-Bis(benzyloxy)phenyl]-3H-[1,3]oxazolo[4,3-a]isoquinolin-3-one
| Molecular Formula | C31H23NO4 |
|---|---|
| Molecular Weight | 473.16 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 473.16272 |
| Heavy Atoms | 36 |
| Complexity | 824.0 |
Chemical Identifiers
| CAS Number | 39949-79-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=C4C5=CC=CC=C5C=CN4C(=O)O3)OCC6=CC=CC=C6 |
| InChIKey | HKRGGMLRMDJLNX-UHFFFAOYSA-N |
Product Overview
1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one (CAS 39949-79-6), with molecular formula C31H23NO4 and molecular weight 473.16 g/mol. IUPAC: 1-[3,4-bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one.
Chemical Property Profile of 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one
Property Insights of 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one
The XLogP value of 6.2 indicates that 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one?
The CAS number of 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one is 39949-79-6.
What is the molecular formula of 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one?
The molecular formula of 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one is C31H23NO4.
What is the molecular weight of 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one?
The molecular weight of 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one is 473.16 g/mol.
Where can I buy 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one?
You can request a quote for 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[3,4-Bis(phenylmethoxy)phenyl]-[1,3]oxazolo[4,3-a]isoquinolin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.