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66365-64-8 | 1-METHYL-4-(PHENYLTHIO)-3,4-DIHYDRO-2(1H)-QUINOLINONE
CAS No: 66365-64-8 Catalog No: AG006MSV MDL No:
Product Description
Catalog Number:
AG006MSV
Chemical Name:
1-METHYL-4-(PHENYLTHIO)-3,4-DIHYDRO-2(1H)-QUINOLINONE
CAS Number:
66365-64-8
Molecular Formula:
C16H15NOS
Molecular Weight:
269.3614
IUPAC Name:
1-methyl-4-phenylsulfanyl-3,4-dihydroquinolin-2-one
InChI:
InChI=1S/C16H15NOS/c1-17-14-10-6-5-9-13(14)15(11-16(17)18)19-12-7-3-2-4-8-12/h2-10,15H,11H2,1H3
InChI Key:
IFCVJGNTWZXCDA-UHFFFAOYSA-N
SMILES:
O=C1CC(Sc2ccccc2)c2c(N1C)cccc2
NSC Number:
298364
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.087g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.362g/mol
Monoisotopic Mass:
269.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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