bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate

C22H14Cl2Cu2N6O8S2 — CID 139170064

IUPACbis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate
SMILES[Cu+].[Cu+].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].c1cnc2nc(-c3nccs3)ccc2c1.c1cnc2nc(-c3nccs3)ccc2c1
InChIInChI=1S/2C11H7N3S.2ClHO4.2Cu/c2*1-2-8-3-4-9(11-13-6-7-15-11)14-10(8)12-5-1;2*2-1(3,4)5;;/h2*1-7H;2*(H,2,3,4,5);;/q;;;;2*+1/p-2
InChIKeyWTBLMUPSXKTQIC-UHFFFAOYSA-L
MW752.52 g/mol
LogP-4.01
Rot. Bonds2

About bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate

bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate (PubChem CID 139170064) has the molecular formula C22H14Cl2Cu2N6O8S2 and a molecular weight of 752.52 g/mol. Its IUPAC name is bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate.

Molecular Properties

Compound Namebis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate
PubChem CID139170064
Molecular FormulaC22H14Cl2Cu2N6O8S2
Molecular Weight752.52 g/mol
Exact Mass749.83
IUPAC Namebis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate
SMILES[Cu+].[Cu+].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].c1cnc2nc(-c3nccs3)ccc2c1.c1cnc2nc(-c3nccs3)ccc2c1
InChIInChI=1S/2C11H7N3S.2ClHO4.2Cu/c2*1-2-8-3-4-9(11-13-6-7-15-11)14-10(8)12-5-1;2*2-1(3,4)5;;/h2*1-7H;2*(H,2,3,4,5);;/q;;;;2*+1/p-2
InChIKeyWTBLMUPSXKTQIC-UHFFFAOYSA-L
XLogP-4.01
TPSA261.82 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds2
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500752.52
LogP ≤ 5-4.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

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Related Compounds

Acetonitrile;2-(1,8-naphthyridin-2-yl)-1,3-thiazole;bis(2-pyridin-2-ylpyridine);ruthenium(2+);diperchlorate
CID 139141158
Tetrakis(acetonitrile);bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);bis(ruthenium(2+));diacetate;diperchlorate
CID 139170066
N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine;platinum
CID 140790958
2-tert-butyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole;2-tert-butyl-5-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazole;2-tert-butyl-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;2-tert-butyl-5-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine;2-tert-butyl-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;3-tert-butyl-5-methyl-4,6-dihydrothieno[2,3-c]pyrrole;4-tert-butyl-2-methylpyrimidine;methane
CID 157693113
CID 160303125
CID 160303125
2-Methyl-[1,3]thiazolo[4,5-b]pyridine;5-methyl-[1,3]thiazolo[4,5-b]pyridine;6-methyl-[1,3]thiazolo[4,5-b]pyridine;7-methyl-[1,3]thiazolo[4,5-b]pyridine
CID 161634769
bis(N,N-dimethylpyrido[2,3-b]indol-9-id-2-amine);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))
CID 176621869
Bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))
CID 176621917
Bis(2-phenyl-1,3-thiazole);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
CID 176621935
Bis(2-fluoropyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))
CID 176621941
Bis(2-tert-butylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))
CID 176621976
Bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);bis(rhodium);bis(trifluoroborane);diacetate
CID 139170067

Frequently Asked Questions

What is the IUPAC name of bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate?
The IUPAC name of bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate (CID 139170064) is bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate.
What is the SMILES notation for bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate?
The canonical SMILES for bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate is [Cu+].[Cu+].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].c1cnc2nc(-c3nccs3)ccc2c1.c1cnc2nc(-c3nccs3)ccc2c1.
What is the InChIKey of bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate?
The InChIKey is WTBLMUPSXKTQIC-UHFFFAOYSA-L. The full InChI is InChI=1S/2C11H7N3S.2ClHO4.2Cu/c2*1-2-8-3-4-9(11-13-6-7-15-11)14-10(8)12-5-1;2*2-1(3,4)5;;/h2*1-7H;2*(H,2,3,4,5);;/q;;;;2*+1/p-2.
What are the key properties of bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate?
bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate has a molecular weight of 752.52 g/mol, XLogP of -4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate is sourced from PubChem (CID 139170064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).