4-chloroisoindolo[2,3-a]quinazoline-5,11-dione

C15H7ClN2O2 — CID 124927728

IUPAC4-chloroisoindolo[2,3-a]quinazoline-5,11-dione
SMILESO=C1c2ccccc2-c2nc(=O)c3c(Cl)cccc3n21
InChIInChI=1S/C15H7ClN2O2/c16-10-6-3-7-11-12(10)14(19)17-13-8-4-1-2-5-9(8)15(20)18(11)13/h1-7H
InChIKeySPMQEJWYVBDXFI-UHFFFAOYSA-N
MW282.69 g/mol
LogP2.72
Rot. Bonds

About 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione

4-chloroisoindolo[2,3-a]quinazoline-5,11-dione (PubChem CID 124927728) has the molecular formula C15H7ClN2O2 and a molecular weight of 282.69 g/mol. Its IUPAC name is 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione.

Molecular Properties

Compound Name4-chloroisoindolo[2,3-a]quinazoline-5,11-dione
PubChem CID124927728
Molecular FormulaC15H7ClN2O2
Molecular Weight282.69 g/mol
Exact Mass282.02
IUPAC Name4-chloroisoindolo[2,3-a]quinazoline-5,11-dione
SMILESO=C1c2ccccc2-c2nc(=O)c3c(Cl)cccc3n21
InChIInChI=1S/C15H7ClN2O2/c16-10-6-3-7-11-12(10)14(19)17-13-8-4-1-2-5-9(8)15(20)18(11)13/h1-7H
InChIKeySPMQEJWYVBDXFI-UHFFFAOYSA-N
XLogP2.72
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.69
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-bis(2-chlorophenyl)imidazo[1,2-b]isoindol-5-one
CID 102591136
5-chloro-2-phenyl-1-propan-2-ylquinazolin-4-one
CID 13064615
7-phenylisoindolo[2,3-a]benzimidazol-11-one
CID 23881857
CID 171104438
CID 171104438
5-chloro-3-phenyl-9-(2-phenylphenyl)carbazole
CID 90370377
4,19-dichloro-9,14-diphenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaene
CID 135130688
4-chloro-7,7-dimethyl-9-(1H-pyrazol-4-yl)indolo[1,2-a]quinazolin-5-one
CID 171104326
5-chloro-1-ethylquinazolin-4-one
CID 171104503
2-(2-chlorophenyl)-5-fluoro-3-phenylquinazolin-4-one
CID 155671982
(6R)-6-tert-butyl-3-thia-1,12-diazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-2(10),4(9),12,14,16,18-hexaene-11,20-dione
CID 51851817
2-[6-(1,3-dioxoisoindol-2-yl)-2-pyridinyl]isoindole-1,3-dione
CID 555038
2-[(3-chloro-2-methylphenyl)methyl]isoindole-1,3-dione
CID 59323393

Frequently Asked Questions

What is the IUPAC name of 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione?
The IUPAC name of 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione (CID 124927728) is 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione.
What is the SMILES notation for 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione?
The canonical SMILES for 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione is O=C1c2ccccc2-c2nc(=O)c3c(Cl)cccc3n21.
What is the InChIKey of 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione?
The InChIKey is SPMQEJWYVBDXFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H7ClN2O2/c16-10-6-3-7-11-12(10)14(19)17-13-8-4-1-2-5-9(8)15(20)18(11)13/h1-7H.
What are the key properties of 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione?
4-chloroisoindolo[2,3-a]quinazoline-5,11-dione has a molecular weight of 282.69 g/mol, XLogP of 2.72, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloroisoindolo[2,3-a]quinazoline-5,11-dione is sourced from PubChem (CID 124927728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).