9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole

C34H23N3 — CID 58037505

IUPAC9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole
SMILESc1ccc(-c2nccn2-c2ccc3c(c2)-c2cc(-n4c5ccccc5c5ccccc54)ccc2C3)cc1
InChIInChI=1S/C34H23N3/c1-2-8-23(9-3-1)34-35-18-19-36(34)26-16-14-24-20-25-15-17-27(22-31(25)30(24)21-26)37-32-12-6-4-10-28(32)29-11-5-7-13-33(29)37/h1-19,21-22H,20H2
InChIKeyXDTDEISBALPTHL-UHFFFAOYSA-N
MW473.58 g/mol
LogP8.21
Rot. Bonds3

About 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole

9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole (PubChem CID 58037505) has the molecular formula C34H23N3 and a molecular weight of 473.58 g/mol. Its IUPAC name is 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole.

Molecular Properties

Compound Name9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole
PubChem CID58037505
Molecular FormulaC34H23N3
Molecular Weight473.58 g/mol
Exact Mass473.19
IUPAC Name9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole
SMILESc1ccc(-c2nccn2-c2ccc3c(c2)-c2cc(-n4c5ccccc5c5ccccc54)ccc2C3)cc1
InChIInChI=1S/C34H23N3/c1-2-8-23(9-3-1)34-35-18-19-36(34)26-16-14-24-20-25-15-17-27(22-31(25)30(24)21-26)37-32-12-6-4-10-28(32)29-11-5-7-13-33(29)37/h1-19,21-22H,20H2
InChIKeyXDTDEISBALPTHL-UHFFFAOYSA-N
XLogP8.21
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms37
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.58
LogP ≤ 58.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole?
The IUPAC name of 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole (CID 58037505) is 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole.
What is the SMILES notation for 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole?
The canonical SMILES for 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole is c1ccc(-c2nccn2-c2ccc3c(c2)-c2cc(-n4c5ccccc5c5ccccc54)ccc2C3)cc1.
What is the InChIKey of 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole?
The InChIKey is XDTDEISBALPTHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H23N3/c1-2-8-23(9-3-1)34-35-18-19-36(34)26-16-14-24-20-25-15-17-27(22-31(25)30(24)21-26)37-32-12-6-4-10-28(32)29-11-5-7-13-33(29)37/h1-19,21-22H,20H2.
What are the key properties of 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole?
9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole has a molecular weight of 473.58 g/mol, XLogP of 8.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole is sourced from PubChem (CID 58037505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).