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478249-87-5 | 3-(4-hydroxyphenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanehydrazide
CAS No: 478249-87-5 Catalog No: AG00IT0O MDL No:MFCD02571756
Product Description
Catalog Number:
AG00IT0O
Chemical Name:
3-(4-hydroxyphenyl)-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)propanehydrazide
CAS Number:
478249-87-5
Molecular Formula:
C17H17N3O3
Molecular Weight:
311.3352
MDL Number:
MFCD02571756
IUPAC Name:
3-(4-hydroxyphenyl)-3-(3-oxo-1H-isoindol-2-yl)propanehydrazide
InChI:
InChI=1S/C17H17N3O3/c18-19-16(22)9-15(11-5-7-13(21)8-6-11)20-10-12-3-1-2-4-14(12)17(20)23/h1-8,15,21H,9-10,18H2,(H,19,22)
InChI Key:
PRPYOAJDNPMOAU-UHFFFAOYSA-N
SMILES:
NNC(=O)CC(N1Cc2c(C1=O)cccc2)c1ccc(cc1)O
Properties
Complexity:
448
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.127g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
311.341g/mol
Monoisotopic Mass:
311.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
95.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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