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Home > Indoles and Oxindole > 89508-05-4
89508-05-4 | 9H-Pyrido[3,4-b]indole-3-carboxamide, N-(1,2-dimethylpropyl)-
CAS No: 89508-05-4 Catalog No: AG00419Q MDL No:
Product Description
Catalog Number:
AG00419Q
Chemical Name:
9H-Pyrido[3,4-b]indole-3-carboxamide, N-(1,2-dimethylpropyl)-
CAS Number:
89508-05-4
Molecular Formula:
C17H19N3O
Molecular Weight:
281.3523
IUPAC Name:
N-(3-methylbutan-2-yl)-9H-pyrido[3,4-b]indole-3-carboxamide
InChI:
InChI=1S/C17H19N3O/c1-10(2)11(3)19-17(21)15-8-13-12-6-4-5-7-14(12)20-16(13)9-18-15/h4-11,20H,1-3H3,(H,19,21)
InChI Key:
IGJPTEBFFPLNHL-UHFFFAOYSA-N
SMILES:
CC(C(NC(=O)c1ncc2c(c1)c1ccccc1[nH]2)C)C
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.153g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.359g/mol
Monoisotopic Mass:
281.153g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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