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1EXCIPIENTS BY APPLICATIONS

Chemistry

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Also known as:
Molecular Formula
C24H20N4O
Molecular Weight
380.4  g/mol
InChI Key
KMDLOETUWUPGMB-BXCCFQQFSA-N

Scarlet Red
1 2D Structure

Scarlet Red

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1Z)-1-[[2-methyl-4-[(2-methylphenyl)diazenyl]phenyl]hydrazinylidene]naphthalen-2-one
2.1.2 InChI
InChI=1S/C24H20N4O/c1-16-7-3-6-10-21(16)26-25-19-12-13-22(17(2)15-19)27-28-24-20-9-5-4-8-18(20)11-14-23(24)29/h3-15,27H,1-2H3/b26-25?,28-24-
2.1.3 InChI Key
KMDLOETUWUPGMB-BXCCFQQFSA-N
2.1.4 Canonical SMILES
CC1=CC=CC=C1N=NC2=CC(=C(C=C2)NN=C3C(=O)C=CC4=CC=CC=C43)C
2.1.5 Isomeric SMILES
CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N/N=C/3\C(=O)C=CC4=CC=CC=C43)C
2.2 Create Date
2005-09-09
3 Chemical and Physical Properties
Molecular Weight 380.4 g/mol
Molecular Formula C24H20N4O
XLogP36.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass380.16371127 g/mol
Monoisotopic Mass380.16371127 g/mol
Topological Polar Surface Area66.2 A^2
Heavy Atom Count29
Formal Charge0
Complexity670
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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