6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one

C23H15N3O2 — CID 147850768

IUPAC6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one
SMILESO=C1Nc2ccccc2C1C1c2ccccc2-n2c1nc1ccccc1c2=O
InChIInChI=1S/C23H15N3O2/c27-22-20(13-7-1-4-10-16(13)25-22)19-15-9-3-6-12-18(15)26-21(19)24-17-11-5-2-8-14(17)23(26)28/h1-12,19-20H,(H,25,27)
InChIKeyHUTUZCAEMMNIDO-UHFFFAOYSA-N
MW365.39 g/mol
LogP3.57
Rot. Bonds1

About 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one

6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one (PubChem CID 147850768) has the molecular formula C23H15N3O2 and a molecular weight of 365.39 g/mol. Its IUPAC name is 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one.

Molecular Properties

Compound Name6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one
PubChem CID147850768
Molecular FormulaC23H15N3O2
Molecular Weight365.39 g/mol
Exact Mass365.12
IUPAC Name6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one
SMILESO=C1Nc2ccccc2C1C1c2ccccc2-n2c1nc1ccccc1c2=O
InChIInChI=1S/C23H15N3O2/c27-22-20(13-7-1-4-10-16(13)25-22)19-15-9-3-6-12-18(15)26-21(19)24-17-11-5-2-8-14(17)23(26)28/h1-12,19-20H,(H,25,27)
InChIKeyHUTUZCAEMMNIDO-UHFFFAOYSA-N
XLogP3.57
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one?
The IUPAC name of 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one (CID 147850768) is 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one.
What is the SMILES notation for 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one?
The canonical SMILES for 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one is O=C1Nc2ccccc2C1C1c2ccccc2-n2c1nc1ccccc1c2=O.
What is the InChIKey of 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one?
The InChIKey is HUTUZCAEMMNIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N3O2/c27-22-20(13-7-1-4-10-16(13)25-22)19-15-9-3-6-12-18(15)26-21(19)24-17-11-5-2-8-14(17)23(26)28/h1-12,19-20H,(H,25,27).
What are the key properties of 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one?
6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one has a molecular weight of 365.39 g/mol, XLogP of 3.57, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-oxo-1,3-dihydroindol-3-yl)-6H-indolo[2,1-b]quinazolin-12-one is sourced from PubChem (CID 147850768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).