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823192-01-4 | 4-Thiazolidinone, 3-butyl-5-methyl-2-(1-naphthalenyl)-
CAS No: 823192-01-4 Catalog No: AG005522 MDL No:
Product Description
Catalog Number:
AG005522
Chemical Name:
4-Thiazolidinone, 3-butyl-5-methyl-2-(1-naphthalenyl)-
CAS Number:
823192-01-4
Molecular Formula:
C18H21NOS
Molecular Weight:
299.4304
IUPAC Name:
3-butyl-5-methyl-2-naphthalen-1-yl-1,3-thiazolidin-4-one
InChI:
InChI=1S/C18H21NOS/c1-3-4-12-19-17(20)13(2)21-18(19)16-11-7-9-14-8-5-6-10-15(14)16/h5-11,13,18H,3-4,12H2,1-2H3
InChI Key:
LUFYURUUAUSEFE-UHFFFAOYSA-N
SMILES:
CCCCN1C(=O)C(SC1c1cccc2c1cccc2)C
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.134g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.432g/mol
Monoisotopic Mass:
299.134g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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