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524933-35-5 | 2-(4-tert-butylphenyl)quinoline-4-carbohydrazide
CAS No: 524933-35-5 Catalog No: AG00JBW2 MDL No:MFCD02244449
Product Description
Catalog Number:
AG00JBW2
Chemical Name:
2-(4-tert-butylphenyl)quinoline-4-carbohydrazide
CAS Number:
524933-35-5
Molecular Formula:
C20H21N3O
Molecular Weight:
319.4002
MDL Number:
MFCD02244449
IUPAC Name:
2-(4-tert-butylphenyl)quinoline-4-carbohydrazide
InChI:
InChI=1S/C20H21N3O/c1-20(2,3)14-10-8-13(9-11-14)18-12-16(19(24)23-21)15-6-4-5-7-17(15)22-18/h4-12H,21H2,1-3H3,(H,23,24)
InChI Key:
CWMDJPHKLUJZFH-UHFFFAOYSA-N
SMILES:
NNC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.168g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
319.408g/mol
Monoisotopic Mass:
319.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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