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Home > Indoles and Oxindole > 74011-07-7
74011-07-7 | 3-Acetamido-1-methyl-5H-pyrido(4,3-b)indole
CAS No: 74011-07-7 Catalog No: AG005A28 MDL No:
Product Description
Catalog Number:
AG005A28
Chemical Name:
3-Acetamido-1-methyl-5H-pyrido(4,3-b)indole
CAS Number:
74011-07-7
Molecular Formula:
C14H13N3O
Molecular Weight:
239.2725
IUPAC Name:
N-(1-methyl-5H-pyrido[4,3-b]indol-3-yl)acetamide
InChI:
InChI=1S/C14H13N3O/c1-8-14-10-5-3-4-6-11(10)17-12(14)7-13(15-8)16-9(2)18/h3-7,17H,1-2H3,(H,15,16,18)
InChI Key:
VEMIKRRYUNCKIY-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1nc(C)c2c(c1)[nH]c1c2cccc1
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.106g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.278g/mol
Monoisotopic Mass:
239.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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