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918646-33-0 | [1(2H),3'-Biquinolin]-2-one, 3,4-dihydro-3,4,4,8-tetramethyl-
CAS No: 918646-33-0 Catalog No: AG006CJ4 MDL No:
Product Description
Catalog Number:
AG006CJ4
Chemical Name:
[1(2H),3'-Biquinolin]-2-one, 3,4-dihydro-3,4,4,8-tetramethyl-
CAS Number:
918646-33-0
Molecular Formula:
C22H22N2O
Molecular Weight:
330.4229
IUPAC Name:
3,4,4,8-tetramethyl-1-quinolin-3-yl-3H-quinolin-2-one
InChI:
InChI=1S/C22H22N2O/c1-14-8-7-10-18-20(14)24(21(25)15(2)22(18,3)4)17-12-16-9-5-6-11-19(16)23-13-17/h5-13,15H,1-4H3
InChI Key:
WMQVZPLBXTZOTO-UHFFFAOYSA-N
SMILES:
O=C1N(c2cnc3c(c2)cccc3)c2c(C)cccc2C(C1C)(C)C
Properties
Complexity:
516
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.173g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.431g/mol
Monoisotopic Mass:
330.173g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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