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Home > Indoles and Oxindole > 1171934-80-7
1171934-80-7 | 1-(3-Methyl-2-phenyl-indol-1-yl)-3-piperazin-1-yl-propan-2-ol
CAS No: 1171934-80-7 Catalog No: AG01EQUR MDL No:
Product Description
Catalog Number:
AG01EQUR
Chemical Name:
1-(3-Methyl-2-phenyl-indol-1-yl)-3-piperazin-1-yl-propan-2-ol
CAS Number:
1171934-80-7
Molecular Formula:
C22H27N3O
Molecular Weight:
349.4693
IUPAC Name:
1-(3-methyl-2-phenylindol-1-yl)-3-piperazin-1-ylpropan-2-ol
InChI:
InChI=1S/C22H27N3O/c1-17-20-9-5-6-10-21(20)25(22(17)18-7-3-2-4-8-18)16-19(26)15-24-13-11-23-12-14-24/h2-10,19,23,26H,11-16H2,1H3
InChI Key:
OXVBGTIXHQHKHV-UHFFFAOYSA-N
SMILES:
OC(Cn1c2ccccc2c(c1c1ccccc1)C)CN1CCNCC1
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.215g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
349.478g/mol
Monoisotopic Mass:
349.215g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
40.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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