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1021868-80-3 | (+/-)-3-[(4-IODOPHENYL)-1-PIPERAZYL] METHYLPYRROLO [2,3-B] PYRIMIDINE TRIHYDROCHLORIDE
CAS No: 1021868-80-3 Catalog No: AG009QKW MDL No:
Product Description
Catalog Number:
AG009QKW
Chemical Name:
(+/-)-3-[(4-IODOPHENYL)-1-PIPERAZYL] METHYLPYRROLO [2,3-B] PYRIMIDINE TRIHYDROCHLORIDE
CAS Number:
1021868-80-3
IUPAC Name:
3-[[4-(4-iodophenyl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine;trihydrochloride
InChI:
InChI=1S/C18H19IN4.3ClH/c19-15-3-5-16(6-4-15)23-10-8-22(9-11-23)13-14-12-21-18-17(14)2-1-7-20-18;;;/h1-7,12H,8-11,13H2,(H,20,21);3*1H
InChI Key:
YOURSPNOEWYAKO-UHFFFAOYSA-N
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
525.995g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
527.656g/mol
Monoisotopic Mass:
525.995g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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