1-Octyl-2,5-bis(1,4-naphthoquinon-2-yl)pyrrole

HCID 10696448
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Basic information

Standard SMILES
CCCCCCCCn1c(C2=CC(=O)c3ccccc3C2=O)ccc1C1=CC(=O)c2ccccc2C1=O
InChIKey
ABKXLGKRKBVUJX-UHFFFAOYSA-N
Molecular formula
C32H29NO4
Average molar mass
491.6 g/mol

Names & identifiers

Preferred name
1-Octyl-2,5-bis(1,4-naphthoquinon-2-yl)pyrrole
IUPAC
2-[5-(1,4-dioxonaphthalen-2-yl)-1-octylpyrrol-2-yl]naphthalene-1,4-dione

Names & synonyms

SCHEMBL7601133ABKXLGKRKBVUJX-UHFFFAOYSA-N1-octyl-2,5-bis(1,4-naphthoquinon-2-yl)pyrrole

Database identifiers

PubChem CID
10696448
Nikkaji
J1.458.040I

Properties

Computed structural properties

XLogP
6.4
Topological polar surface area
73.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
37

Related reactions

1 records
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Compound notes

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