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Home > Indoles and Oxindole > 112583-67-2
112583-67-2 | 6-Quinolinecarboxamide, N-[2-(1H-indol-3-yl)ethyl]-
CAS No: 112583-67-2 Catalog No: AG00826D MDL No:
Product Description
Catalog Number:
AG00826D
Chemical Name:
6-Quinolinecarboxamide, N-[2-(1H-indol-3-yl)ethyl]-
CAS Number:
112583-67-2
Molecular Formula:
C20H17N3O
Molecular Weight:
315.3685
IUPAC Name:
N-[2-(1H-indol-3-yl)ethyl]quinoline-6-carboxamide
InChI:
InChI=1S/C20H17N3O/c24-20(15-7-8-18-14(12-15)4-3-10-21-18)22-11-9-16-13-23-19-6-2-1-5-17(16)19/h1-8,10,12-13,23H,9,11H2,(H,22,24)
InChI Key:
XNJFUDQWUDEICT-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(c1)cccn2)NCCc1c[nH]c2c1cccc2
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.137g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
315.376g/mol
Monoisotopic Mass:
315.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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