Phen-DC 3
2-N,9-N-bis(1-methylquinolin-1-ium-3-yl)-1,10-phenanthroline-2,9-dicarboxamide
Molecular Identity
Phen-DC 3
2-N,9-N-bis(1-methylquinolin-1-ium-3-yl)-1,10-phenanthroline-2,9-dicarboxamide
PubChem CID: 44449504
2D Structure
Properties
C34H26N6O2+2
Molecular Formula
550.60
Molecular Weight
g/mol
550.2117
Exact Mass
Da
5.6
XLogP
Above Lipinski threshold
91.7
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
902
Complexity
SMILES
Canonical SMILES
SMILES: C[N+]1=CC(=CC2=CC=CC=C21)NC(=O)C3=NC4=C(C=CC5=C4N=C(C=C5)C(=O)NC6=CC7=CC=CC=C7[N+](=C6)C)C=C3Isomeric SMILES
SMILES: C[N+]1=CC(=CC2=CC=CC=C21)NC(=O)C3=NC4=C(C=CC5=C4N=C(C=C5)C(=O)NC6=CC7=CC=CC=C7[N+](=C6)C)C=C3Synonyms(19)
Phen-DC 3RefChem:860511988-691-3929895-45-4Phen-DC3942936-75-6CHEMBL259739N2,N9-Bis(1-Methylquinolin-3-Yl)-1,10-Phenanthroline-2,9-DicarboxamidePQ3orb1707869SCHEMBL29459586SCHEMBL29593044SMB93675BDBM50376748AKOS040740870
Data from PubChem (NCBI)
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Drug Network
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