9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione

C20H11NO4 — CID 11844481

IUPAC9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione
SMILESO=C1OC(=O)c2c1c(-c1ccccc1)cc1[nH]c3ccc(O)cc3c21
InChIInChI=1S/C20H11NO4/c22-11-6-7-14-13(8-11)16-15(21-14)9-12(10-4-2-1-3-5-10)17-18(16)20(24)25-19(17)23/h1-9,21-22H
InChIKeyNTXJPDUUOKDBNE-UHFFFAOYSA-N
MW329.31 g/mol
LogP4.00
Rot. Bonds1

About 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione

9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione (PubChem CID 11844481) has the molecular formula C20H11NO4 and a molecular weight of 329.31 g/mol. Its IUPAC name is 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione.

Molecular Properties

Compound Name9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione
PubChem CID11844481
Molecular FormulaC20H11NO4
Molecular Weight329.31 g/mol
Exact Mass329.07
IUPAC Name9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione
SMILESO=C1OC(=O)c2c1c(-c1ccccc1)cc1[nH]c3ccc(O)cc3c21
InChIInChI=1S/C20H11NO4/c22-11-6-7-14-13(8-11)16-15(21-14)9-12(10-4-2-1-3-5-10)17-18(16)20(24)25-19(17)23/h1-9,21-22H
InChIKeyNTXJPDUUOKDBNE-UHFFFAOYSA-N
XLogP4.00
TPSA79.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.31
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione?
The IUPAC name of 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione (CID 11844481) is 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione.
What is the SMILES notation for 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione?
The canonical SMILES for 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione is O=C1OC(=O)c2c1c(-c1ccccc1)cc1[nH]c3ccc(O)cc3c21.
What is the InChIKey of 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione?
The InChIKey is NTXJPDUUOKDBNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11NO4/c22-11-6-7-14-13(8-11)16-15(21-14)9-12(10-4-2-1-3-5-10)17-18(16)20(24)25-19(17)23/h1-9,21-22H.
What are the key properties of 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione?
9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione has a molecular weight of 329.31 g/mol, XLogP of 4.00, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxy-4-phenyl-6H-furo[3,4-c]carbazole-1,3-dione is sourced from PubChem (CID 11844481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).