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Home > Indoles and Oxindole > 203394-24-5
203394-24-5 | 3H-Pyrido[3,4-b]indole, 4,9-dihydro-4-phenyl-
CAS No: 203394-24-5 Catalog No: AG0028V8 MDL No:
Product Description
Catalog Number:
AG0028V8
Chemical Name:
3H-Pyrido[3,4-b]indole, 4,9-dihydro-4-phenyl-
CAS Number:
203394-24-5
Molecular Formula:
C17H14N2
Molecular Weight:
246.3065
IUPAC Name:
4-phenyl-4,9-dihydro-3H-pyrido[3,4-b]indole
InChI:
InChI=1S/C17H14N2/c1-2-6-12(7-3-1)14-10-18-11-16-17(14)13-8-4-5-9-15(13)19-16/h1-9,11,14,19H,10H2
InChI Key:
BWYMDVGOFWJYSR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1CN=Cc2c1c1ccccc1[nH]2
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.313g/mol
Monoisotopic Mass:
246.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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