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137503-47-0 | 2-Thiazolamine, 4-[5-(4-nitrophenyl)-2-furanyl]-N-phenyl-
CAS No: 137503-47-0 Catalog No: AG0013ED MDL No:
Product Description
Catalog Number:
AG0013ED
Chemical Name:
2-Thiazolamine, 4-[5-(4-nitrophenyl)-2-furanyl]-N-phenyl-
CAS Number:
137503-47-0
Molecular Formula:
C19H13N3O3S
Molecular Weight:
363.3898
IUPAC Name:
4-[5-(4-nitrophenyl)furan-2-yl]-N-phenyl-1,3-thiazol-2-amine
InChI:
InChI=1S/C19H13N3O3S/c23-22(24)15-8-6-13(7-9-15)17-10-11-18(25-17)16-12-26-19(21-16)20-14-4-2-1-3-5-14/h1-12H,(H,20,21)
InChI Key:
HTNBBJDKDCJXJL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)c1ccc(o1)c1csc(n1)Nc1ccccc1
NSC Number:
638033
Properties
Complexity:
475
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.068g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
363.391g/mol
Monoisotopic Mass:
363.068g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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