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Home > Indoles and Oxindole > 145253-98-1
145253-98-1 | 1H-Indole, 3-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-
CAS No: 145253-98-1 Catalog No: AG001KQA MDL No:MFCD02681193
Product Description
Catalog Number:
AG001KQA
Chemical Name:
1H-Indole, 3-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-
CAS Number:
145253-98-1
Molecular Formula:
C20H23N3O
Molecular Weight:
321.4161
MDL Number:
MFCD02681193
IUPAC Name:
3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1H-indole
InChI:
InChI=1S/C20H23N3O/c1-24-20-9-5-4-8-19(20)23-12-10-22(11-13-23)15-16-14-21-18-7-3-2-6-17(16)18/h2-9,14,21H,10-13,15H2,1H3
InChI Key:
OJUQWLAXOIFADL-UHFFFAOYSA-N
SMILES:
COc1ccccc1N1CCN(CC1)Cc1c[nH]c2c1cccc2
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.184g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
321.424g/mol
Monoisotopic Mass:
321.184g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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