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918330-25-3

918330-25-3 | 1H-Isoindol-1-one, 5-[(2,4-difluorophenyl)amino]-2,3-dihydro-2-methyl-

CAS No: 918330-25-3 Catalog No: AG006GCO MDL No:

Product Description

Catalog Number:
AG006GCO
Chemical Name:
1H-Isoindol-1-one, 5-[(2,4-difluorophenyl)amino]-2,3-dihydro-2-methyl-
CAS Number:
918330-25-3
Molecular Formula:
C15H12F2N2O
Molecular Weight:
274.2654
IUPAC Name:
5-(2,4-difluoroanilino)-2-methyl-3H-isoindol-1-one
InChI:
InChI=1S/C15H12F2N2O/c1-19-8-9-6-11(3-4-12(9)15(19)20)18-14-5-2-10(16)7-13(14)17/h2-7,18H,8H2,1H3
InChI Key:
UKZPXWBYQMISHF-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)Nc1ccc2c(c1)CN(C2=O)C

Properties

Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.092g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.271g/mol
Monoisotopic Mass:
274.092g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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