2-bromoindolo[1,2-a]benzimidazol-11-one

C14H7BrN2O — CID 146638668

IUPAC2-bromoindolo[1,2-a]benzimidazol-11-one
SMILESO=C1c2cc(Br)ccc2-n2c1nc1ccccc12
InChIInChI=1S/C14H7BrN2O/c15-8-5-6-11-9(7-8)13(18)14-16-10-3-1-2-4-12(10)17(11)14/h1-7H
InChIKeyZHDMOQKZTAQVIZ-UHFFFAOYSA-N
MW299.13 g/mol
LogP3.33
Rot. Bonds

About 2-bromoindolo[1,2-a]benzimidazol-11-one

2-bromoindolo[1,2-a]benzimidazol-11-one (PubChem CID 146638668) has the molecular formula C14H7BrN2O and a molecular weight of 299.13 g/mol. Its IUPAC name is 2-bromoindolo[1,2-a]benzimidazol-11-one.

Molecular Properties

Compound Name2-bromoindolo[1,2-a]benzimidazol-11-one
PubChem CID146638668
Molecular FormulaC14H7BrN2O
Molecular Weight299.13 g/mol
Exact Mass297.97
IUPAC Name2-bromoindolo[1,2-a]benzimidazol-11-one
SMILESO=C1c2cc(Br)ccc2-n2c1nc1ccccc12
InChIInChI=1S/C14H7BrN2O/c15-8-5-6-11-9(7-8)13(18)14-16-10-3-1-2-4-12(10)17(11)14/h1-7H
InChIKeyZHDMOQKZTAQVIZ-UHFFFAOYSA-N
XLogP3.33
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.13
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-bromoindolo[1,2-a]benzimidazol-11-one?
The IUPAC name of 2-bromoindolo[1,2-a]benzimidazol-11-one (CID 146638668) is 2-bromoindolo[1,2-a]benzimidazol-11-one.
What is the SMILES notation for 2-bromoindolo[1,2-a]benzimidazol-11-one?
The canonical SMILES for 2-bromoindolo[1,2-a]benzimidazol-11-one is O=C1c2cc(Br)ccc2-n2c1nc1ccccc12.
What is the InChIKey of 2-bromoindolo[1,2-a]benzimidazol-11-one?
The InChIKey is ZHDMOQKZTAQVIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7BrN2O/c15-8-5-6-11-9(7-8)13(18)14-16-10-3-1-2-4-12(10)17(11)14/h1-7H.
What are the key properties of 2-bromoindolo[1,2-a]benzimidazol-11-one?
2-bromoindolo[1,2-a]benzimidazol-11-one has a molecular weight of 299.13 g/mol, XLogP of 3.33, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromoindolo[1,2-a]benzimidazol-11-one is sourced from PubChem (CID 146638668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).