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Home > Indoles and Oxindole > 1323056-03-6
1323056-03-6 | 2-(1-methylidene-3-oxo-2,3-dihydro-1H-isoindol-2-yl)-N-(quinolin-3-yl)propanamide
CAS No: 1323056-03-6 Catalog No: AG01B8A2 MDL No:MFCD17922016
Product Description
Catalog Number:
AG01B8A2
Chemical Name:
2-(1-methylidene-3-oxo-2,3-dihydro-1H-isoindol-2-yl)-N-(quinolin-3-yl)propanamide
CAS Number:
1323056-03-6
Molecular Formula:
C21H17N3O2
Molecular Weight:
343.3786
MDL Number:
MFCD17922016
IUPAC Name:
2-(1-methylidene-3-oxoisoindol-2-yl)-N-quinolin-3-ylpropanamide
InChI:
InChI=1S/C21H17N3O2/c1-13-17-8-4-5-9-18(17)21(26)24(13)14(2)20(25)23-16-11-15-7-3-6-10-19(15)22-12-16/h3-12,14H,1H2,2H3,(H,23,25)
InChI Key:
ANWKIFSWPBSZPB-UHFFFAOYSA-N
SMILES:
O=C(C(N1C(=C)c2c(C1=O)cccc2)C)Nc1cnc2c(c1)cccc2
Properties
Complexity:
590
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.132g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
343.386g/mol
Monoisotopic Mass:
343.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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