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823191-99-7 | 4-Thiazolidinone, 3-butyl-2-(1-naphthalenyl)-
CAS No: 823191-99-7 Catalog No: AG008KY5 MDL No:
Product Description
Catalog Number:
AG008KY5
Chemical Name:
4-Thiazolidinone, 3-butyl-2-(1-naphthalenyl)-
CAS Number:
823191-99-7
Molecular Formula:
C17H19NOS
Molecular Weight:
285.4039
IUPAC Name:
3-butyl-2-naphthalen-1-yl-1,3-thiazolidin-4-one
InChI:
InChI=1S/C17H19NOS/c1-2-3-11-18-16(19)12-20-17(18)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,17H,2-3,11-12H2,1H3
InChI Key:
JQCZXJKVDKHAGY-UHFFFAOYSA-N
SMILES:
CCCCN1C(=O)CSC1c1cccc2c1cccc2
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.119g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.405g/mol
Monoisotopic Mass:
285.119g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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