9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole

C37H23NO2 — CID 163450703

IUPAC9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole
SMILESc1ccc2c(c1)oc1cccc(-c3ccc4c(c3)-c3ccc(-n5c6ccccc6c6ccccc65)cc3OC4)c12
InChIInChI=1S/C37H23NO2/c1-4-12-32-27(8-1)28-9-2-5-13-33(28)38(32)25-18-19-29-31-20-23(16-17-24(31)22-39-36(29)21-25)26-11-7-15-35-37(26)30-10-3-6-14-34(30)40-35/h1-21H,22H2
InChIKeyBGIWXYQHUHPUTF-UHFFFAOYSA-N
MW513.60 g/mol
LogP9.91
Rot. Bonds2

About 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole

9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole (PubChem CID 163450703) has the molecular formula C37H23NO2 and a molecular weight of 513.60 g/mol. Its IUPAC name is 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole.

Molecular Properties

Compound Name9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole
PubChem CID163450703
Molecular FormulaC37H23NO2
Molecular Weight513.60 g/mol
Exact Mass513.17
IUPAC Name9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole
SMILESc1ccc2c(c1)oc1cccc(-c3ccc4c(c3)-c3ccc(-n5c6ccccc6c6ccccc65)cc3OC4)c12
InChIInChI=1S/C37H23NO2/c1-4-12-32-27(8-1)28-9-2-5-13-33(28)38(32)25-18-19-29-31-20-23(16-17-24(31)22-39-36(29)21-25)26-11-7-15-35-37(26)30-10-3-6-14-34(30)40-35/h1-21H,22H2
InChIKeyBGIWXYQHUHPUTF-UHFFFAOYSA-N
XLogP9.91
TPSA27.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms40
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.60
LogP ≤ 59.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole?
The IUPAC name of 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole (CID 163450703) is 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole.
What is the SMILES notation for 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole?
The canonical SMILES for 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole is c1ccc2c(c1)oc1cccc(-c3ccc4c(c3)-c3ccc(-n5c6ccccc6c6ccccc65)cc3OC4)c12.
What is the InChIKey of 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole?
The InChIKey is BGIWXYQHUHPUTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H23NO2/c1-4-12-32-27(8-1)28-9-2-5-13-33(28)38(32)25-18-19-29-31-20-23(16-17-24(31)22-39-36(29)21-25)26-11-7-15-35-37(26)30-10-3-6-14-34(30)40-35/h1-21H,22H2.
What are the key properties of 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole?
9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole has a molecular weight of 513.60 g/mol, XLogP of 9.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9-dibenzofuran-1-yl-6H-benzo[c]chromen-3-yl)carbazole is sourced from PubChem (CID 163450703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).