bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide

C176H106F12N18O8Pt6 — CID 157080588

IUPACbis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide
SMILESCOc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3F)c3cc(F)ccc3n4-c3cc(C)ccn3)cc(F)c2)c1.COc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3F)c3cc(F)ccc3n4-c3cc(C)ccn3)cc(F)c2)c1.Cc1cccnc1-n1c2[c-]c(-c3[c-]c(Oc4ccccn4)ccc3)ccc2c2ccccc21.Cc1ccnc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)c1.FC(F)(F)c1ccc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)nc1.FC(F)(F)c1cccc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/2C30H18F3N3O2.2C29H16F3N3O.2C29H19N3O.6Pt/c2*1-17-5-7-34-29(9-17)36-27-4-3-19(31)13-24(27)25-15-26(33)23(16-28(25)36)18-10-20(32)12-22(11-18)38-30-14-21(37-2)6-8-35-30;30-29(31,32)26-11-6-12-27(34-26)35-24-10-2-1-9-22(24)23-15-14-20(18-25(23)35)19-7-5-8-21(17-19)36-28-13-3-4-16-33-28;30-29(31,32)21-12-14-27(34-18-21)35-25-9-2-1-8-23(25)24-13-11-20(17-26(24)35)19-6-5-7-22(16-19)36-28-10-3-4-15-33-28;1-20-8-7-17-31-29(20)32-26-12-3-2-11-24(26)25-15-14-22(19-27(25)32)21-9-6-10-23(18-21)33-28-13-4-5-16-30-28;1-20-14-16-30-28(17-20)32-26-10-3-2-9-24(26)25-13-12-22(19-27(25)32)21-7-6-8-23(18-21)33-29-11-4-5-15-31-29;;;;;;/h2*3-10,12-15H,1-2H3;1-16H;1-15,18H;2*2-17H,1H3;;;;;;/q6*-2;6*+2
InChIKeyOXHVSPYERMUCRR-UHFFFAOYSA-N
MW3999.35 g/mol
LogP43.91
Rot. Bonds26

About bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide

bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide (PubChem CID 157080588) has the molecular formula C176H106F12N18O8Pt6 and a molecular weight of 3999.35 g/mol. Its IUPAC name is bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide.

Molecular Properties

Compound Namebis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide
PubChem CID157080588
Molecular FormulaC176H106F12N18O8Pt6
Molecular Weight3999.35 g/mol
Exact Mass3996.61
IUPAC Namebis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide
SMILESCOc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3F)c3cc(F)ccc3n4-c3cc(C)ccn3)cc(F)c2)c1.COc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3F)c3cc(F)ccc3n4-c3cc(C)ccn3)cc(F)c2)c1.Cc1cccnc1-n1c2[c-]c(-c3[c-]c(Oc4ccccn4)ccc3)ccc2c2ccccc21.Cc1ccnc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)c1.FC(F)(F)c1ccc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)nc1.FC(F)(F)c1cccc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/2C30H18F3N3O2.2C29H16F3N3O.2C29H19N3O.6Pt/c2*1-17-5-7-34-29(9-17)36-27-4-3-19(31)13-24(27)25-15-26(33)23(16-28(25)36)18-10-20(32)12-22(11-18)38-30-14-21(37-2)6-8-35-30;30-29(31,32)26-11-6-12-27(34-26)35-24-10-2-1-9-22(24)23-15-14-20(18-25(23)35)19-7-5-8-21(17-19)36-28-13-3-4-16-33-28;30-29(31,32)21-12-14-27(34-18-21)35-25-9-2-1-8-23(25)24-13-11-20(17-26(24)35)19-6-5-7-22(16-19)36-28-10-3-4-15-33-28;1-20-8-7-17-31-29(20)32-26-12-3-2-11-24(26)25-15-14-22(19-27(25)32)21-9-6-10-23(18-21)33-28-13-4-5-16-30-28;1-20-14-16-30-28(17-20)32-26-10-3-2-9-24(26)25-13-12-22(19-27(25)32)21-7-6-8-23(18-21)33-29-11-4-5-15-31-29;;;;;;/h2*3-10,12-15H,1-2H3;1-16H;1-15,18H;2*2-17H,1H3;;;;;;/q6*-2;6*+2
InChIKeyOXHVSPYERMUCRR-UHFFFAOYSA-N
XLogP43.91
TPSA258.10 Ų
H-Bond Donors
H-Bond Acceptors26
Rotatable Bonds26
Heavy Atoms220
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003999.35
LogP ≤ 543.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide?
The IUPAC name of bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide (CID 157080588) is bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide.
What is the SMILES notation for bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide?
The canonical SMILES for bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide is COc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3F)c3cc(F)ccc3n4-c3cc(C)ccn3)cc(F)c2)c1.COc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3F)c3cc(F)ccc3n4-c3cc(C)ccn3)cc(F)c2)c1.Cc1cccnc1-n1c2[c-]c(-c3[c-]c(Oc4ccccn4)ccc3)ccc2c2ccccc21.Cc1ccnc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)c1.FC(F)(F)c1ccc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)nc1.FC(F)(F)c1cccc(-n2c3[c-]c(-c4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccccc32)n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide?
The InChIKey is OXHVSPYERMUCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C30H18F3N3O2.2C29H16F3N3O.2C29H19N3O.6Pt/c2*1-17-5-7-34-29(9-17)36-27-4-3-19(31)13-24(27)25-15-26(33)23(16-28(25)36)18-10-20(32)12-22(11-18)38-30-14-21(37-2)6-8-35-30;30-29(31,32)26-11-6-12-27(34-26)35-24-10-2-1-9-22(24)23-15-14-20(18-25(23)35)19-7-5-8-21(17-19)36-28-13-3-4-16-33-28;30-29(31,32)21-12-14-27(34-18-21)35-25-9-2-1-8-23(25)24-13-11-20(17-26(24)35)19-6-5-7-22(16-19)36-28-10-3-4-15-33-28;1-20-8-7-17-31-29(20)32-26-12-3-2-11-24(26)25-15-14-22(19-27(25)32)21-9-6-10-23(18-21)33-28-13-4-5-16-30-28;1-20-14-16-30-28(17-20)32-26-10-3-2-9-24(26)25-13-12-22(19-27(25)32)21-7-6-8-23(18-21)33-29-11-4-5-15-31-29;;;;;;/h2*3-10,12-15H,1-2H3;1-16H;1-15,18H;2*2-17H,1H3;;;;;;/q6*-2;6*+2.
What are the key properties of bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide?
bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide has a molecular weight of 3999.35 g/mol, XLogP of 43.91, 26 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3,6-difluoro-2-[3-fluoro-5-[(4-methoxy-2-pyridinyl)oxy]benzene-6-id-1-yl]-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+));2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[5-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide;2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-[6-(trifluoromethyl)-2-pyridinyl]-1H-carbazol-1-ide is sourced from PubChem (CID 157080588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).