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74008-09-6

74008-09-6 | 4-Thiazolidinone,2-(3-nitrophenyl)-3-(phenylamino)-

CAS No: 74008-09-6 Catalog No: AG005IJO MDL No:

Product Description

Catalog Number:
AG005IJO
Chemical Name:
4-Thiazolidinone,2-(3-nitrophenyl)-3-(phenylamino)-
CAS Number:
74008-09-6
Molecular Formula:
C15H13N3O3S
Molecular Weight:
315.3470
IUPAC Name:
3-anilino-2-(3-nitrophenyl)-1,3-thiazolidin-4-one
InChI:
InChI=1S/C15H13N3O3S/c19-14-10-22-15(11-5-4-8-13(9-11)18(20)21)17(14)16-12-6-2-1-3-7-12/h1-9,15-16H,10H2
InChI Key:
AKFJWHDQTOMVCG-UHFFFAOYSA-N
SMILES:
O=C1CSC(N1Nc1ccccc1)c1cccc(c1)[N+](=O)[O-]

Properties

Complexity:
423  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.068g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
315.347g/mol
Monoisotopic Mass:
315.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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