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832081-75-1 | 2-Quinoxalinamine, N-(4-methylphenyl)-3-(2-thienyl)-
CAS No: 832081-75-1 Catalog No: AG004VF0 MDL No:
Product Description
Catalog Number:
AG004VF0
Chemical Name:
2-Quinoxalinamine, N-(4-methylphenyl)-3-(2-thienyl)-
CAS Number:
832081-75-1
Molecular Formula:
C19H15N3S
Molecular Weight:
317.4075
IUPAC Name:
N-(4-methylphenyl)-3-thiophen-2-ylquinoxalin-2-amine
InChI:
InChI=1S/C19H15N3S/c1-13-8-10-14(11-9-13)20-19-18(17-7-4-12-23-17)21-15-5-2-3-6-16(15)22-19/h2-12H,1H3,(H,20,22)
InChI Key:
INFYKTWGNAHFDG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)Nc1nc2ccccc2nc1c1cccs1
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.099g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.41g/mol
Monoisotopic Mass:
317.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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