2-chloro-12H-indolo[2,1-b]quinazolin-6-one

C15H9ClN2O — CID 15150649

IUPAC2-chloro-12H-indolo[2,1-b]quinazolin-6-one
SMILESO=C1C2=Nc3ccc(Cl)cc3CN2c2ccccc21
InChIInChI=1S/C15H9ClN2O/c16-10-5-6-12-9(7-10)8-18-13-4-2-1-3-11(13)14(19)15(18)17-12/h1-7H,8H2
InChIKeyXKOZBTMHUVITMD-UHFFFAOYSA-N
MW268.70 g/mol
LogP3.59
Rot. Bonds

About 2-chloro-12H-indolo[2,1-b]quinazolin-6-one

2-chloro-12H-indolo[2,1-b]quinazolin-6-one (PubChem CID 15150649) has the molecular formula C15H9ClN2O and a molecular weight of 268.70 g/mol. Its IUPAC name is 2-chloro-12H-indolo[2,1-b]quinazolin-6-one.

Molecular Properties

Compound Name2-chloro-12H-indolo[2,1-b]quinazolin-6-one
PubChem CID15150649
Molecular FormulaC15H9ClN2O
Molecular Weight268.70 g/mol
Exact Mass268.04
IUPAC Name2-chloro-12H-indolo[2,1-b]quinazolin-6-one
SMILESO=C1C2=Nc3ccc(Cl)cc3CN2c2ccccc21
InChIInChI=1S/C15H9ClN2O/c16-10-5-6-12-9(7-10)8-18-13-4-2-1-3-11(13)14(19)15(18)17-12/h1-7H,8H2
InChIKeyXKOZBTMHUVITMD-UHFFFAOYSA-N
XLogP3.59
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.70
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-12H-indolo[2,1-b]quinazolin-6-one?
The IUPAC name of 2-chloro-12H-indolo[2,1-b]quinazolin-6-one (CID 15150649) is 2-chloro-12H-indolo[2,1-b]quinazolin-6-one.
What is the SMILES notation for 2-chloro-12H-indolo[2,1-b]quinazolin-6-one?
The canonical SMILES for 2-chloro-12H-indolo[2,1-b]quinazolin-6-one is O=C1C2=Nc3ccc(Cl)cc3CN2c2ccccc21.
What is the InChIKey of 2-chloro-12H-indolo[2,1-b]quinazolin-6-one?
The InChIKey is XKOZBTMHUVITMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClN2O/c16-10-5-6-12-9(7-10)8-18-13-4-2-1-3-11(13)14(19)15(18)17-12/h1-7H,8H2.
What are the key properties of 2-chloro-12H-indolo[2,1-b]quinazolin-6-one?
2-chloro-12H-indolo[2,1-b]quinazolin-6-one has a molecular weight of 268.70 g/mol, XLogP of 3.59, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-12H-indolo[2,1-b]quinazolin-6-one is sourced from PubChem (CID 15150649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).