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1264299-56-0 | 1H-Pyrido[3,4-b]indol-1-one, 3-amino-2,9-dihydro-9-methyl-
CAS No: 1264299-56-0 Catalog No: AG000SSB MDL No:MFCD23701474
Product Description
Catalog Number:
AG000SSB
Chemical Name:
1H-Pyrido[3,4-b]indol-1-one, 3-amino-2,9-dihydro-9-methyl-
CAS Number:
1264299-56-0
Molecular Formula:
C12H11N3O
Molecular Weight:
213.2352
MDL Number:
MFCD23701474
IUPAC Name:
3-amino-9-methyl-2H-pyrido[3,4-b]indol-1-one
InChI:
InChI=1S/C12H11N3O/c1-15-9-5-3-2-4-7(9)8-6-10(13)14-12(16)11(8)15/h2-6H,1H3,(H3,13,14,16)
InChI Key:
QCSMVDIJSYEWNW-UHFFFAOYSA-N
SMILES:
Nc1[nH]c(=O)c2c(c1)c1ccccc1n2C
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.24g/mol
Monoisotopic Mass:
213.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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