2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride

C56H78ClMnN2O16+ — CID 135889345

IUPAC2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride
SMILESCOCCOCCOCCOCCOCCOc1ccccc1-c1cc(/C=N/C2CCCCC2/N=C/c2cc(-c3ccccc3OCCOCCOCCOCCOCCOC)cc(OC)c2O)c(O)c(OC)c1.[Cl-].[Mn+2]
InChIInChI=1S/C56H78N2O16.ClH.Mn/c1-61-17-19-65-21-23-67-25-27-69-29-31-71-33-35-73-51-15-9-5-11-47(51)43-37-45(55(59)53(39-43)63-3)41-57-49-13-7-8-14-50(49)58-42-46-38-44(40-54(64-4)56(46)60)48-12-6-10-16-52(48)74-36-34-72-32-30-70-28-26-68-24-22-66-20-18-62-2;;/h5-6,9-12,15-16,37-42,49-50,59-60H,7-8,13-14,17-36H2,1-4H3;1H;/q;;+2/p-1/b57-41+,58-42+;;
InChIKeyWXXCBQYDRDZGHD-SDJIVNNASA-M
MW1125.63 g/mol
LogP4.48
Rot. Bonds40

About 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride

2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride (PubChem CID 135889345) has the molecular formula C56H78ClMnN2O16+ and a molecular weight of 1125.63 g/mol. Its IUPAC name is 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride.

Molecular Properties

Compound Name2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride
PubChem CID135889345
Molecular FormulaC56H78ClMnN2O16+
Molecular Weight1125.63 g/mol
Exact Mass1124.44
IUPAC Name2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride
SMILESCOCCOCCOCCOCCOCCOc1ccccc1-c1cc(/C=N/C2CCCCC2/N=C/c2cc(-c3ccccc3OCCOCCOCCOCCOCCOC)cc(OC)c2O)c(O)c(OC)c1.[Cl-].[Mn+2]
InChIInChI=1S/C56H78N2O16.ClH.Mn/c1-61-17-19-65-21-23-67-25-27-69-29-31-71-33-35-73-51-15-9-5-11-47(51)43-37-45(55(59)53(39-43)63-3)41-57-49-13-7-8-14-50(49)58-42-46-38-44(40-54(64-4)56(46)60)48-12-6-10-16-52(48)74-36-34-72-32-30-70-28-26-68-24-22-66-20-18-62-2;;/h5-6,9-12,15-16,37-42,49-50,59-60H,7-8,13-14,17-36H2,1-4H3;1H;/q;;+2/p-1/b57-41+,58-42+;;
InChIKeyWXXCBQYDRDZGHD-SDJIVNNASA-M
XLogP4.48
TPSA194.40 Ų
H-Bond Donors2
H-Bond Acceptors18
Rotatable Bonds40
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001125.63
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride with MolForge

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Related Compounds

2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-(2-methoxyethoxy)ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-(2-methoxyethoxy)ethoxy]phenyl]phenol
CID 135889324
2-[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]ethyliminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride
CID 135889343
2-[[2-[(E)-[2-hydroxy-3-methoxy-5-[2-[2-(2-methoxyethoxy)ethoxy]phenyl]phenyl]methylideneamino]-3-pyridinyl]iminomethyl]-6-methoxy-4-[2-[2-(2-methoxyethoxy)ethoxy]phenyl]phenol;manganese(2+);chloride
CID 135889325
1-(2-methoxyphenyl)-N-[(1R,2R)-2-[(2-methoxyphenyl)methylideneamino]cyclohexyl]methanimine
CID 11268143
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]benzene
CID 102202030
3-[[(1R,2R)-2-[(2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]-1-(2-methoxynaphthalen-1-yl)naphthalen-2-ol
CID 136731917
3-[2-(2-methoxyethoxy)phenyl]cyclohex-2-en-1-ol
CID 104662829
6-[[(1S,2S)-2-[[2-hydroxy-5-methoxy-4-methyl-3-(1-phenylpropyl)phenyl]methylideneamino]cyclohexyl]iminomethyl]-4-methoxy-3-methyl-2-(1-phenylpropyl)phenol;manganese;hexafluorophosphate
CID 139264730
3-[2-(2-methoxyethoxy)phenyl]pyridine
CID 141192201
5-(2-aminophenyl)-2-hydroxy-3-methoxybenzaldehyde
CID 39224754
4-tert-butyl-2-[[(1S,2S)-2-[(5-tert-butyl-2-hydroxy-3-pyridin-2-ylphenyl)methylideneamino]cyclohexyl]iminomethyl]-6-pyridin-2-ylphenol;nickel
CID 135451855
2-[2-[bis[2-[[2-hydroxy-3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]methylideneamino]ethyl]amino]ethyliminomethyl]-6-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenol
CID 135438085

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride?
The IUPAC name of 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride (CID 135889345) is 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride.
What is the SMILES notation for 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride?
The canonical SMILES for 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride is COCCOCCOCCOCCOCCOc1ccccc1-c1cc(/C=N/C2CCCCC2/N=C/c2cc(-c3ccccc3OCCOCCOCCOCCOCCOC)cc(OC)c2O)c(O)c(OC)c1.[Cl-].[Mn+2].
What is the InChIKey of 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride?
The InChIKey is WXXCBQYDRDZGHD-SDJIVNNASA-M. The full InChI is InChI=1S/C56H78N2O16.ClH.Mn/c1-61-17-19-65-21-23-67-25-27-69-29-31-71-33-35-73-51-15-9-5-11-47(51)43-37-45(55(59)53(39-43)63-3)41-57-49-13-7-8-14-50(49)58-42-46-38-44(40-54(64-4)56(46)60)48-12-6-10-16-52(48)74-36-34-72-32-30-70-28-26-68-24-22-66-20-18-62-2;;/h5-6,9-12,15-16,37-42,49-50,59-60H,7-8,13-14,17-36H2,1-4H3;1H;/q;;+2/p-1/b57-41+,58-42+;;.
What are the key properties of 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride?
2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride has a molecular weight of 1125.63 g/mol, XLogP of 4.48, 40 rotatable bonds, 2 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[[2-hydroxy-3-methoxy-5-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenyl]methylideneamino]cyclohexyl]iminomethyl]-6-methoxy-4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]phenol;manganese(2+);chloride is sourced from PubChem (CID 135889345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).