Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-
TL;DR: Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- (CAS 77508-74-8) is a chemical compound with molecular formula C22H17NO2 and molecular weight 327.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-diphenyl-4,5-dihydro-1,2-oxazol-4-yl)-phenylmethanone
Also Known As: 4-benzoyl-3,5-diphenyl-4,5-dihydro-1,2-oxazole, (3,5-Diphenyl-4,5-dihydro-4-isoxazolyl)(phenyl)methanone, 4,5-Dihydro-3,5-diphenylisoxazol-4-yl(phenyl) ketone, (3,5-diphenyl-4,5-dihydroisoxazol-4-yl)(phenyl)methanone, Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-
| Molecular Formula | C22H17NO2 |
|---|---|
| Molecular Weight | 327.13 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.12592 |
| Heavy Atoms | 25 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 77508-74-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(C(=NO2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4 |
| InChIKey | VHPSYLOUPJPDHX-UHFFFAOYSA-N |
Product Overview
Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- (CAS 77508-74-8), with molecular formula C22H17NO2 and molecular weight 327.13 g/mol. IUPAC: (3,5-diphenyl-4,5-dihydro-1,2-oxazol-4-yl)-phenylmethanone.
Chemical Property Profile of Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-
Property Insights of Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-
The XLogP value of 4.9 indicates that Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- has 0 hydrogen bond donor(s) and 3 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 Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-?
The CAS number of Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- is 77508-74-8.
What is the molecular formula of Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-?
The molecular formula of Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- is C22H17NO2.
What is the molecular weight of Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-?
The molecular weight of Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- is 327.13 g/mol.
Where can I buy Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-?
You can request a quote for Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, (4,5-dihydro-3,5-diphenyl-4-isoxazolyl)phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.