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1528793-12-5 | (1-isobutyl-1H-indol-3-yl)(naphthalen-1-yl)methanone
CAS No: 1528793-12-5 Catalog No: AG01EOWW MDL No:
Product Description
Catalog Number:
AG01EOWW
Chemical Name:
(1-isobutyl-1H-indol-3-yl)(naphthalen-1-yl)methanone
CAS Number:
1528793-12-5
Molecular Formula:
C23H21NO
Molecular Weight:
327.4189
IUPAC Name:
[1-(2-methylpropyl)indol-3-yl]-naphthalen-1-ylmethanone
InChI:
InChI=1S/C23H21NO/c1-16(2)14-24-15-21(19-11-5-6-13-22(19)24)23(25)20-12-7-9-17-8-3-4-10-18(17)20/h3-13,15-16H,14H2,1-2H3
InChI Key:
XNFHBVYEKFAQLX-UHFFFAOYSA-N
SMILES:
CC(Cn1cc(c2c1cccc2)C(=O)c1cccc2c1cccc2)C
Properties
Complexity:
473
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.162g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.427g/mol
Monoisotopic Mass:
327.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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