![6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one structure](/static/products/1853/185333-65-7.webp)
6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one
TL;DR: 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one (CAS 185333-65-7) is a chemical compound with molecular formula C15H13N3O2 and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-phenyl-6-prop-2-enyl-[1,2]oxazolo[3,4-d]pyridazin-7-one
Also Known As: 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one, 3-methyl-4-phenyl-6-prop-2-enyl-[1,2]oxazolo[3,4-d]pyridazin-7-one, 3-methyl-4-phenyl-6-(prop-2-en-1-yl)-6H,7H-[1,2]oxazolo[3,4-d]pyridazin-7-one, 6-allyl-3-methyl-4-phenyl-isoxazolo[3,4-d]pyridazin-7-one, Isoxazolo[3,4-d]pyridazin-7(6H)-one, 3-methyl-4-phenyl-6-(2-propenyl)-
| Molecular Formula | C15H13N3O2 |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 2.54592 |
| Topological Polar Surface Area | 60.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.10077 |
| Heavy Atoms | 20 |
| Complexity | 831.44104 |
Chemical Identifiers
| CAS Number | 185333-65-7 |
|---|---|
| SMILES | CC1=C2C(=NN(C(=O)C2=NO1)CC=C)C3=CC=CC=C3 |
Product Overview
6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one (CAS 185333-65-7), with molecular formula C15H13N3O2 and molecular weight 267.10 g/mol. IUPAC: 3-methyl-4-phenyl-6-prop-2-enyl-[1,2]oxazolo[3,4-d]pyridazin-7-one.
Chemical Property Profile of 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one
Property Insights of 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one
The XLogP value of 2.54592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one. The TPSA of 60.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one. Following Lipinski's Rule of Five, 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one 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 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one?
The CAS number of 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one is 185333-65-7.
What is the molecular formula of 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one?
The molecular formula of 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one is C15H13N3O2.
What is the molecular weight of 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one?
The molecular weight of 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one is 267.10 g/mol.
Where can I buy 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one?
You can request a quote for 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-allyl-3-methyl-4-phenylisoxazolo[3,4-d]pyridazin-7(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.