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132459-02-0 | 2,5-Pyrrolidinedione, 3-(3-chlorophenyl)-1-(4-methyl-2-pyridinyl)-
CAS No: 132459-02-0 Catalog No: AG0010PB MDL No:
Product Description
Catalog Number:
AG0010PB
Chemical Name:
2,5-Pyrrolidinedione, 3-(3-chlorophenyl)-1-(4-methyl-2-pyridinyl)-
CAS Number:
132459-02-0
Molecular Formula:
C16H13ClN2O2
Molecular Weight:
300.7396
IUPAC Name:
3-(3-chlorophenyl)-1-(4-methylpyridin-2-yl)pyrrolidine-2,5-dione
InChI:
InChI=1S/C16H13ClN2O2/c1-10-5-6-18-14(7-10)19-15(20)9-13(16(19)21)11-3-2-4-12(17)8-11/h2-8,13H,9H2,1H3
InChI Key:
PVNKBNXQADKTPK-UHFFFAOYSA-N
SMILES:
Cc1ccnc(c1)N1C(=O)CC(C1=O)c1cccc(c1)Cl
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.067g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.742g/mol
Monoisotopic Mass:
300.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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