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2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl- structure
Fine Chemical

2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-

TL;DR: 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl- (CAS 116610-80-1) is a chemical compound with molecular formula C14H13N3O2 and molecular weight 255.10077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3,3-dimethyl-5-(6-oxo-1H-pyridazin-3-yl)-1H-indol-2-one

Also Known As: Dehydroindolidan, 3,3-dimethyl-5-(6-oxo-1H-pyridazin-3-yl)-1H-indol-2-one, 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-, 5-(6-hydroxypyridazin-3-yl)-3,3-dimethyl-1,3-dihydro-2h-indol-2-one, 2H-Indol-2-one,5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-

CAS Number
116610-80-1
Molecular Formula
C14H13N3O2
Molecular Weight
255.10077 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (3 patents) Pharmaceutical Intermediates (2 patents)

Technical Specifications

Molecular FormulaC14H13N3O2
Molecular Weight255.10077 g/mol
XLogP1.0
Topological Polar Surface Area (TPSA)70.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds1
Exact Mass255.10077 Da
Heavy Atoms19
Complexity493.0
SMILESCC1(C2=C(C=CC(=C2)C3=NNC(=O)C=C3)NC1=O)C
InChIKeyXYUOWTGQHOUXIO-UHFFFAOYSA-N

Chemical Property Profile of 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-

XLogP
1.0
TPSA (Topological Polar Surface Area)
70.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
1
Heavy Atoms
19
Complexity
493.0
Exact Mass
255.10077
Monoisotopic Mass
255.10077
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-

The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-. Following Lipinski's Rule of Five, 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-?

The CAS number of 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl- is 116610-80-1.

What is the molecular formula of 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-?

The molecular formula of 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl- is C14H13N3O2.

What is the molecular weight of 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-?

The molecular weight of 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl- is 255.10077 g/mol.

Where can I buy 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-?

You can request a quote for 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl-?

Yes, CoreyChem provides custom synthesis services for 2H-Indol-2-one, 5-(1,6-dihydro-6-oxo-3-pyridazinyl)-1,3-dihydro-3,3-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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