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832696-14-7 | Thieno[3,2-c]pyridin-4-amine, 3-(4-aminophenyl)-7-(4-isoquinolinyl)-
CAS No: 832696-14-7 Catalog No: AG0056RH MDL No:
Product Description
Catalog Number:
AG0056RH
Chemical Name:
Thieno[3,2-c]pyridin-4-amine, 3-(4-aminophenyl)-7-(4-isoquinolinyl)-
CAS Number:
832696-14-7
Molecular Formula:
C22H16N4S
Molecular Weight:
368.4542
IUPAC Name:
3-(4-aminophenyl)-7-isoquinolin-4-ylthieno[3,2-c]pyridin-4-amine
InChI:
InChI=1S/C22H16N4S/c23-15-7-5-13(6-8-15)19-12-27-21-18(11-26-22(24)20(19)21)17-10-25-9-14-3-1-2-4-16(14)17/h1-12H,23H2,(H2,24,26)
InChI Key:
MUFWQGLUKPIVLA-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1csc2c1c(N)ncc2c1cncc2c1cccc2
Properties
Complexity:
509
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.11g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
368.458g/mol
Monoisotopic Mass:
368.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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