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1006485-25-1 | 1-ethyl-4-{6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-yl}-1H-pyrazole
CAS No: 1006485-25-1 Catalog No: AG01AO5V MDL No:MFCD08558190
Product Description
Catalog Number:
AG01AO5V
Chemical Name:
1-ethyl-4-{6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-yl}-1H-pyrazole
CAS Number:
1006485-25-1
MDL Number:
MFCD08558190
IUPAC Name:
1-(1-ethylpyrazol-4-yl)-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
InChI:
InChI=1S/C17H20N4/c1-3-21-10-12(9-19-21)16-17-13(6-7-18-16)14-8-11(2)4-5-15(14)20-17/h4-5,8-10,16,18,20H,3,6-7H2,1-2H3
InChI Key:
HBKRHBAPTNJQBY-UHFFFAOYSA-N
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.169g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
280.375g/mol
Monoisotopic Mass:
280.169g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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