CAS 77152-22-8 | 5H-Indeno[1,2-c]pyridazin-5-one, 3-phenyl- | CAS Number 77152-22-8

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77152-22-8 | 5H-Indeno[1,2-c]pyridazin-5-one, 3-phenyl-

CAS No: 77152-22-8 Catalog No: AG0055I9 MDL No:MFCD00232435

Product Description

Catalog Number:

AG0055I9

Chemical Name:

5H-Indeno[1,2-c]pyridazin-5-one, 3-phenyl-

CAS Number:

77152-22-8

Molecular Formula:

C17H10N2O

Molecular Weight:

258.2741

MDL Number:

MFCD00232435

IUPAC Name:

3-phenylindeno[1,2-c]pyridazin-5-one

InChI:

InChI=1S/C17H10N2O/c20-17-13-9-5-4-8-12(13)16-14(17)10-15(18-19-16)11-6-2-1-3-7-11/h1-10H

InChI Key:

ORLUBUYLVCUFDE-UHFFFAOYSA-N

SMILES:

O=C1c2cc(nnc2c2c1cccc2)c1ccccc1

NSC Number:

663883

Properties

Complexity:

377

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

258.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

258.28g/mol

Monoisotopic Mass:

258.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7

Literature

Title	Journal
Impact of species-dependent differences on screening, design, and development of MAO B inhibitors.	Journal of medicinal chemistry 20061019
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501