6-chloro-[1]benzofuro[3,2-g]isoquinoline

C15H8ClNO — CID 166502382

IUPAC6-chloro-[1]benzofuro[3,2-g]isoquinoline
SMILESClc1cccc2oc3cc4cnccc4cc3c12
InChIInChI=1S/C15H8ClNO/c16-12-2-1-3-13-15(12)11-6-9-4-5-17-8-10(9)7-14(11)18-13/h1-8H
InChIKeyGIIJPRGMTBLMOG-UHFFFAOYSA-N
MW253.69 g/mol
LogP4.79
Rot. Bonds

About 6-chloro-[1]benzofuro[3,2-g]isoquinoline

6-chloro-[1]benzofuro[3,2-g]isoquinoline (PubChem CID 166502382) has the molecular formula C15H8ClNO and a molecular weight of 253.69 g/mol. Its IUPAC name is 6-chloro-[1]benzofuro[3,2-g]isoquinoline.

Molecular Properties

Compound Name6-chloro-[1]benzofuro[3,2-g]isoquinoline
PubChem CID166502382
Molecular FormulaC15H8ClNO
Molecular Weight253.69 g/mol
Exact Mass253.03
IUPAC Name6-chloro-[1]benzofuro[3,2-g]isoquinoline
SMILESClc1cccc2oc3cc4cnccc4cc3c12
InChIInChI=1S/C15H8ClNO/c16-12-2-1-3-13-15(12)11-6-9-4-5-17-8-10(9)7-14(11)18-13/h1-8H
InChIKeyGIIJPRGMTBLMOG-UHFFFAOYSA-N
XLogP4.79
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.69
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

10-bromo-7-chloro-[1]benzofuro[2,3-g]isoquinoline
CID 166502709
7-chloro-10-[2-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-g]isoquinoline
CID 166502646
6-(4-dibenzofuran-1-yl-6-naphthalen-2-yl-1,3,5-triazin-2-yl)-[1]benzofuro[3,2-g]isoquinoline
CID 166502297
6-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-[1]benzofuro[3,2-g]isoquinoline
CID 166502386
7-dibenzofuran-1-yl-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-g]isoquinoline
CID 166502685
7-[10-(3-phenylphenyl)anthracen-9-yl]-[1]benzofuro[3,2-g]isoquinoline
CID 121340878
6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)-[1]benzofuro[3,2-g]isoquinoline
CID 166502343
10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-8-phenyl-[1]benzofuro[2,3-g]isoquinoline
CID 166502717
2-(9-chlorodibenzofuran-2-yl)-4,6-diphenyl-1,3,5-triazine
CID 163739599
6-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-[1]benzofuro[3,2-g]isoquinoline;10-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-g]isoquinoline;10-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-g]quinoline
CID 167568795
6-[4-naphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-g]isoquinoline;10-[4-naphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-g]isoquinoline;10-[4-naphthalen-2-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-g]quinoline
CID 167576165
6-[4-(4,6-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-2-yl)naphthalen-1-yl]-[1]benzofuro[3,2-g]isoquinoline
CID 166800197

Frequently Asked Questions

What is the IUPAC name of 6-chloro-[1]benzofuro[3,2-g]isoquinoline?
The IUPAC name of 6-chloro-[1]benzofuro[3,2-g]isoquinoline (CID 166502382) is 6-chloro-[1]benzofuro[3,2-g]isoquinoline.
What is the SMILES notation for 6-chloro-[1]benzofuro[3,2-g]isoquinoline?
The canonical SMILES for 6-chloro-[1]benzofuro[3,2-g]isoquinoline is Clc1cccc2oc3cc4cnccc4cc3c12.
What is the InChIKey of 6-chloro-[1]benzofuro[3,2-g]isoquinoline?
The InChIKey is GIIJPRGMTBLMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClNO/c16-12-2-1-3-13-15(12)11-6-9-4-5-17-8-10(9)7-14(11)18-13/h1-8H.
What are the key properties of 6-chloro-[1]benzofuro[3,2-g]isoquinoline?
6-chloro-[1]benzofuro[3,2-g]isoquinoline has a molecular weight of 253.69 g/mol, XLogP of 4.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-[1]benzofuro[3,2-g]isoquinoline is sourced from PubChem (CID 166502382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).