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1171934-81-8 | C-(3,5-Dimethyl-2-phenyl-1H-indol-7-yl)-methylamine
CAS No: 1171934-81-8 Catalog No: AG01F8O5 MDL No:
Product Description
Catalog Number:
AG01F8O5
Chemical Name:
C-(3,5-Dimethyl-2-phenyl-1H-indol-7-yl)-methylamine
CAS Number:
1171934-81-8
Molecular Formula:
C17H18N2
Molecular Weight:
250.3382
IUPAC Name:
(3,5-dimethyl-2-phenyl-1H-indol-7-yl)methanamine
InChI:
InChI=1S/C17H18N2/c1-11-8-14(10-18)17-15(9-11)12(2)16(19-17)13-6-4-3-5-7-13/h3-9,19H,10,18H2,1-2H3
InChI Key:
OIINLGJKMKEXOT-UHFFFAOYSA-N
SMILES:
NCc1cc(C)cc2c1[nH]c(c2C)c1ccccc1
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
250.345g/mol
Monoisotopic Mass:
250.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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