disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)

C98H68Co4N10Na2O10 — CID 139198081

IUPACdisodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)
SMILESCC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].[Co+2].[Co+2].[Co+2].[Co+2].[Na+].[Na+].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12
InChIInChI=1S/4C20H16N2O2.2C9H7NO.4Co.2Na/c4*1-12(15-8-6-13-4-2-10-21-17(13)19(15)23)16-9-7-14-5-3-11-22-18(14)20(16)24;2*11-8-5-1-3-7-4-2-6-10-9(7)8;;;;;;/h4*2-12,23-24H,1H3;2*1-6,11H;;;;;;/q;;;;;;4*+2;2*+1/p-10
InChIKeyYSFPFBDWYBTSEF-UHFFFAOYSA-D
MW1827.39 g/mol
LogP8.94
Rot. Bonds8

About disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)

disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate) (PubChem CID 139198081) has the molecular formula C98H68Co4N10Na2O10 and a molecular weight of 1827.39 g/mol. Its IUPAC name is disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate).

Molecular Properties

Compound Namedisodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)
PubChem CID139198081
Molecular FormulaC98H68Co4N10Na2O10
Molecular Weight1827.39 g/mol
Exact Mass1826.22
IUPAC Namedisodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)
SMILESCC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].[Co+2].[Co+2].[Co+2].[Co+2].[Na+].[Na+].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12
InChIInChI=1S/4C20H16N2O2.2C9H7NO.4Co.2Na/c4*1-12(15-8-6-13-4-2-10-21-17(13)19(15)23)16-9-7-14-5-3-11-22-18(14)20(16)24;2*11-8-5-1-3-7-4-2-6-10-9(7)8;;;;;;/h4*2-12,23-24H,1H3;2*1-6,11H;;;;;;/q;;;;;;4*+2;2*+1/p-10
InChIKeyYSFPFBDWYBTSEF-UHFFFAOYSA-D
XLogP8.94
TPSA359.50 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds8
Heavy Atoms124
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001827.39
LogP ≤ 58.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

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Related Compounds

Tetrakis(quinolin-8-olate);zirconium(4+)
CID 139195714
[2,6-Bis(3,5-dimethylphenyl)phenoxy]-bis[(2-methylquinolin-8-yl)oxy]gallane;(2-tert-butylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-ditert-butylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-dimethyl-4-phenylphenoxy)-bis[[2-(trifluoromethyl)quinolin-8-yl]oxy]gallane
CID 157981729
5,7-Bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)
CID 161054806
Tricopper;hexakis(5,7-dimethylquinolin-8-olate)
CID 139040557
Methoxyoxobis(quinolin-8-olato-kappa^2^N,O)vanadium(V)
CID 139071859
Bis(acetato-kappaO)bis(mu~3~-quinolin-8-olato-kappa^4^N,O:O:O)tetrakis(mu~2~-quinolin-8-olato-kappa^3^N,O:O)tetrazinc(II) dihydrate
CID 139076884
Tetrakis(quinolin-8-olato-kappa^2^N,O)hafnium(IV) toluene disolvate
CID 139077805
Tetrakis(8-quinolinolato-kappa^2^N,O)hafnium(IV) dimethylformamide solvate monohydrate
CID 139078843
Tetrakis(5,7-dimethylquinolin-8-olato-kappa^2^N,O)hafnium(IV) dimethylformamide disolvate
CID 139082165
cyclo-Tetrakis{mu-N'-[(8-oxidoquinolin-7-yl)methylidene]isonicotinohydrazidato}tetrazinc tetrahydrate
CID 139083911
1,1-bis[kappa-O,N-(8-oxyquinolinato)]silacyclohexane
CID 139102092
[Nitrilotris(3,5-di-tert-butyl-2-cresolato)](8-oxyquinolinato)titanium(IV) acetonitrile hemibenzene solvate
CID 139126214

Frequently Asked Questions

What is the IUPAC name of disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)?
The IUPAC name of disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate) (CID 139198081) is disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate).
What is the SMILES notation for disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)?
The canonical SMILES for disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate) is CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].CC(c1ccc2cccnc2c1[O-])c1ccc2cccnc2c1[O-].[Co+2].[Co+2].[Co+2].[Co+2].[Na+].[Na+].[O-]c1cccc2cccnc12.[O-]c1cccc2cccnc12.
What is the InChIKey of disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)?
The InChIKey is YSFPFBDWYBTSEF-UHFFFAOYSA-D. The full InChI is InChI=1S/4C20H16N2O2.2C9H7NO.4Co.2Na/c4*1-12(15-8-6-13-4-2-10-21-17(13)19(15)23)16-9-7-14-5-3-11-22-18(14)20(16)24;2*11-8-5-1-3-7-4-2-6-10-9(7)8;;;;;;/h4*2-12,23-24H,1H3;2*1-6,11H;;;;;;/q;;;;;;4*+2;2*+1/p-10.
What are the key properties of disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate)?
disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate) has a molecular weight of 1827.39 g/mol, XLogP of 8.94, 8 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;tetrakis(cobalt(2+));tetrakis(7-[1-(8-oxidoquinolin-7-yl)ethyl]quinolin-8-olate);bis(quinolin-8-olate) is sourced from PubChem (CID 139198081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).