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383158-28-9 | 4-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-3-(2-phenylethenyl)-2-thioxo-
CAS No: 383158-28-9 Catalog No: AG00D5QP MDL No:
Product Description
Catalog Number:
AG00D5QP
Chemical Name:
4-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-3-(2-phenylethenyl)-2-thioxo-
CAS Number:
383158-28-9
IUPAC Name:
3-[(E)-2-phenylethenyl]-2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinoline-4-carbonitrile
InChI:
InChI=1S/C18H16N2S/c19-12-16-14-8-4-5-9-17(14)20-18(21)15(16)11-10-13-6-2-1-3-7-13/h1-3,6-7,10-11H,4-5,8-9H2,(H,20,21)/b11-10+
InChI Key:
VOWHUMPDLIHZEO-ZHACJKMWSA-N
Properties
Complexity:
580
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
292.103g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.4g/mol
Monoisotopic Mass:
292.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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