2-(2-bromophenyl)-2-phenyl-1H-indol-3-one

C20H14BrNO — CID 10959434

IUPAC2-(2-bromophenyl)-2-phenyl-1H-indol-3-one
SMILESO=C1c2ccccc2NC1(c1ccccc1)c1ccccc1Br
InChIInChI=1S/C20H14BrNO/c21-17-12-6-5-11-16(17)20(14-8-2-1-3-9-14)19(23)15-10-4-7-13-18(15)22-20/h1-13,22H
InChIKeyBJKVTDYNPMBZKC-UHFFFAOYSA-N
MW364.24 g/mol
LogP5.00
Rot. Bonds2

About 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one

2-(2-bromophenyl)-2-phenyl-1H-indol-3-one (PubChem CID 10959434) has the molecular formula C20H14BrNO and a molecular weight of 364.24 g/mol. Its IUPAC name is 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one.

Molecular Properties

Compound Name2-(2-bromophenyl)-2-phenyl-1H-indol-3-one
PubChem CID10959434
Molecular FormulaC20H14BrNO
Molecular Weight364.24 g/mol
Exact Mass363.03
IUPAC Name2-(2-bromophenyl)-2-phenyl-1H-indol-3-one
SMILESO=C1c2ccccc2NC1(c1ccccc1)c1ccccc1Br
InChIInChI=1S/C20H14BrNO/c21-17-12-6-5-11-16(17)20(14-8-2-1-3-9-14)19(23)15-10-4-7-13-18(15)22-20/h1-13,22H
InChIKeyBJKVTDYNPMBZKC-UHFFFAOYSA-N
XLogP5.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.24
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2S)-2-(2-bromophenyl)-3-oxo-1H-indol-2-yl]acetaldehyde
CID 71608158
(2S)-2-(2-bromophenyl)-2-prop-2-enyl-1H-indol-3-one
CID 101241045
2,2-bis(4-methoxyphenyl)-1H-indol-3-one
CID 138738671
2-(7-nitro-1H-indol-3-yl)-2-phenyl-1H-indol-3-one
CID 146171522
2-ethenyl-2-phenyl-1H-indol-3-one
CID 11118014
2-[(2-bromophenyl)methyl]-2-methyl-1H-indol-3-one
CID 172635518
spiro[1H-indole-2,3'-2-benzofuran]-1',3-dione
CID 132536023
4-bromo-2,2-diphenyl-3H-inden-1-one
CID 71725998
2-(4-oxo-2-phenyl-1,3-dihydroquinolin-2-yl)-2-phenyl-1,3-dihydroquinolin-4-one
CID 3793206
3-chloro-3-phenyl-1H-quinoline-2,4-dione
CID 2785082
2-(2-fluorophenyl)-2-[2-(2-fluorophenyl)-1H-indol-3-yl]-1H-indol-3-one
CID 155664469
2-hexyl-2-phenyl-1H-indol-3-one
CID 132839339

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one?
The IUPAC name of 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one (CID 10959434) is 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one.
What is the SMILES notation for 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one?
The canonical SMILES for 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one is O=C1c2ccccc2NC1(c1ccccc1)c1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one?
The InChIKey is BJKVTDYNPMBZKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14BrNO/c21-17-12-6-5-11-16(17)20(14-8-2-1-3-9-14)19(23)15-10-4-7-13-18(15)22-20/h1-13,22H.
What are the key properties of 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one?
2-(2-bromophenyl)-2-phenyl-1H-indol-3-one has a molecular weight of 364.24 g/mol, XLogP of 5.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-2-phenyl-1H-indol-3-one is sourced from PubChem (CID 10959434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).