9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole

C41H24N2O2 — CID 146266799

IUPAC9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole
SMILESc1cc(-c2cccc3c2oc2c(-c4cccc5c4oc4ccccc45)cccc23)nc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C41H24N2O2/c1-4-21-35-25(11-1)26-12-2-5-22-36(26)43(35)38-24-10-20-34(42-38)33-19-9-18-32-31-17-8-16-30(40(31)45-41(32)33)29-15-7-14-28-27-13-3-6-23-37(27)44-39(28)29/h1-24H
InChIKeyGHWXNFIGBDPGKH-UHFFFAOYSA-N
MW576.66 g/mol
LogP11.31
Rot. Bonds3

About 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole

9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole (PubChem CID 146266799) has the molecular formula C41H24N2O2 and a molecular weight of 576.66 g/mol. Its IUPAC name is 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole.

Molecular Properties

Compound Name9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole
PubChem CID146266799
Molecular FormulaC41H24N2O2
Molecular Weight576.66 g/mol
Exact Mass576.18
IUPAC Name9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole
SMILESc1cc(-c2cccc3c2oc2c(-c4cccc5c4oc4ccccc45)cccc23)nc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C41H24N2O2/c1-4-21-35-25(11-1)26-12-2-5-22-36(26)43(35)38-24-10-20-34(42-38)33-19-9-18-32-31-17-8-16-30(40(31)45-41(32)33)29-15-7-14-28-27-13-3-6-23-37(27)44-39(28)29/h1-24H
InChIKeyGHWXNFIGBDPGKH-UHFFFAOYSA-N
XLogP11.31
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms45
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500576.66
LogP ≤ 511.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole?
The IUPAC name of 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole (CID 146266799) is 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole.
What is the SMILES notation for 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole?
The canonical SMILES for 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole is c1cc(-c2cccc3c2oc2c(-c4cccc5c4oc4ccccc45)cccc23)nc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole?
The InChIKey is GHWXNFIGBDPGKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H24N2O2/c1-4-21-35-25(11-1)26-12-2-5-22-36(26)43(35)38-24-10-20-34(42-38)33-19-9-18-32-31-17-8-16-30(40(31)45-41(32)33)29-15-7-14-28-27-13-3-6-23-37(27)44-39(28)29/h1-24H.
What are the key properties of 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole?
9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole has a molecular weight of 576.66 g/mol, XLogP of 11.31, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-(6-dibenzofuran-4-yldibenzofuran-4-yl)-2-pyridinyl]carbazole is sourced from PubChem (CID 146266799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).