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Home > Indoles and Oxindole > 88488-87-3
88488-87-3 | 1H-Pyrido[4,3-b]indole, 2,3,4,5-tetrahydro-7-methyl-2-(2-methylpropyl)-
CAS No: 88488-87-3 Catalog No: AG0049FY MDL No:
Product Description
Catalog Number:
AG0049FY
Chemical Name:
1H-Pyrido[4,3-b]indole, 2,3,4,5-tetrahydro-7-methyl-2-(2-methylpropyl)-
CAS Number:
88488-87-3
Molecular Formula:
C16H22N2
Molecular Weight:
242.3593
IUPAC Name:
7-methyl-2-(2-methylpropyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole
InChI:
InChI=1S/C16H22N2/c1-11(2)9-18-7-6-15-14(10-18)13-5-4-12(3)8-16(13)17-15/h4-5,8,11,17H,6-7,9-10H2,1-3H3
InChI Key:
FXOQSPWOOMRVRX-UHFFFAOYSA-N
SMILES:
CC(CN1CCc2c(C1)c1ccc(cc1[nH]2)C)C
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.178g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.366g/mol
Monoisotopic Mass:
242.178g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
19A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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