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Home > Indoles and Oxindole > 3335-95-3
3335-95-3 | 1-benzyl-3-phenyl-3H-indol-2-one
CAS No: 3335-95-3 Catalog No: AG007FVJ MDL No:MFCD01566845
Product Description
Catalog Number:
AG007FVJ
Chemical Name:
1-benzyl-3-phenyl-3H-indol-2-one
CAS Number:
3335-95-3
Molecular Formula:
C21H17NO
Molecular Weight:
299.3658
MDL Number:
MFCD01566845
IUPAC Name:
1-benzyl-3-phenyl-3H-indol-2-one
InChI:
InChI=1S/C21H17NO/c23-21-20(17-11-5-2-6-12-17)18-13-7-8-14-19(18)22(21)15-16-9-3-1-4-10-16/h1-14,20H,15H2
InChI Key:
JVOOROOSCRPRFJ-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2ccccc2)c2c(C1c1ccccc1)cccc2
NSC Number:
9515
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.131g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.373g/mol
Monoisotopic Mass:
299.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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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