2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))

C170H164N16O8Pt4 — CID 160657190

IUPAC2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))
SMILESCOc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)c(C)c(C)c(C)c6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)c(C)cc(C)c6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)cc(C)cc6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)cccc6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C44H44N4O2.C43H42N4O2.C42H40N4O2.C41H38N4O2.4Pt/c1-27-28(2)41(43(4,5)6)40(42(29(27)3)44(7,8)9)30-25-46-47(26-30)31-14-13-15-33(22-31)50-34-18-19-36-35-16-11-12-17-37(35)48(38(36)23-34)39-24-32(49-10)20-21-45-39;1-27-21-28(2)41(43(6,7)8)39(40(27)42(3,4)5)29-25-45-46(26-29)30-13-12-14-32(22-30)49-33-17-18-35-34-15-10-11-16-36(34)47(37(35)23-33)38-24-31(48-9)19-20-44-38;1-27-20-35(41(2,3)4)40(36(21-27)42(5,6)7)28-25-44-45(26-28)29-12-11-13-31(22-29)48-32-16-17-34-33-14-9-10-15-37(33)46(38(34)23-32)39-24-30(47-8)18-19-43-39;1-40(2,3)34-15-11-16-35(41(4,5)6)39(34)27-25-43-44(26-27)28-12-10-13-30(22-28)47-31-18-19-33-32-14-8-9-17-36(32)45(37(33)23-31)38-24-29(46-7)20-21-42-38;;;;/h11-21,24-26H,1-10H3;10-21,24-26H,1-9H3;9-21,24-26H,1-8H3;8-21,24-26H,1-7H3;;;;/q4*-2;4*+2
InChIKeyPBXUKCNOVRKOMI-UHFFFAOYSA-N
MW3339.60 g/mol
LogP41.95
Rot. Bonds24

About 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))

2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) (PubChem CID 160657190) has the molecular formula C170H164N16O8Pt4 and a molecular weight of 3339.60 g/mol. Its IUPAC name is 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)).

Molecular Properties

Compound Name2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))
PubChem CID160657190
Molecular FormulaC170H164N16O8Pt4
Molecular Weight3339.60 g/mol
Exact Mass3337.15
IUPAC Name2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))
SMILESCOc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)c(C)c(C)c(C)c6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)c(C)cc(C)c6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)cc(C)cc6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)cccc6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C44H44N4O2.C43H42N4O2.C42H40N4O2.C41H38N4O2.4Pt/c1-27-28(2)41(43(4,5)6)40(42(29(27)3)44(7,8)9)30-25-46-47(26-30)31-14-13-15-33(22-31)50-34-18-19-36-35-16-11-12-17-37(35)48(38(36)23-34)39-24-32(49-10)20-21-45-39;1-27-21-28(2)41(43(6,7)8)39(40(27)42(3,4)5)29-25-45-46(26-29)30-13-12-14-32(22-30)49-33-17-18-35-34-15-10-11-16-36(34)47(37(35)23-33)38-24-31(48-9)19-20-44-38;1-27-20-35(41(2,3)4)40(36(21-27)42(5,6)7)28-25-44-45(26-28)29-12-11-13-31(22-29)48-32-16-17-34-33-14-9-10-15-37(33)46(38(34)23-32)39-24-30(47-8)18-19-43-39;1-40(2,3)34-15-11-16-35(41(4,5)6)39(34)27-25-43-44(26-27)28-12-10-13-30(22-28)47-31-18-19-33-32-14-8-9-17-36(32)45(37(33)23-31)38-24-29(46-7)20-21-42-38;;;;/h11-21,24-26H,1-10H3;10-21,24-26H,1-9H3;9-21,24-26H,1-8H3;8-21,24-26H,1-7H3;;;;/q4*-2;4*+2
InChIKeyPBXUKCNOVRKOMI-UHFFFAOYSA-N
XLogP41.95
TPSA216.40 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds24
Heavy Atoms198
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003339.60
LogP ≤ 541.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The IUPAC name of 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) (CID 160657190) is 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)).
What is the SMILES notation for 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The canonical SMILES for 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) is COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)c(C)c(C)c(C)c6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)c(C)cc(C)c6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)cc(C)cc6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(C(C)(C)C)cccc6C(C)(C)C)cn5)ccc4)ccc3c3ccccc32)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The InChIKey is PBXUKCNOVRKOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H44N4O2.C43H42N4O2.C42H40N4O2.C41H38N4O2.4Pt/c1-27-28(2)41(43(4,5)6)40(42(29(27)3)44(7,8)9)30-25-46-47(26-30)31-14-13-15-33(22-31)50-34-18-19-36-35-16-11-12-17-37(35)48(38(36)23-34)39-24-32(49-10)20-21-45-39;1-27-21-28(2)41(43(6,7)8)39(40(27)42(3,4)5)29-25-45-46(26-29)30-13-12-14-32(22-30)49-33-17-18-35-34-15-10-11-16-36(34)47(37(35)23-33)38-24-31(48-9)19-20-44-38;1-27-20-35(41(2,3)4)40(36(21-27)42(5,6)7)28-25-44-45(26-28)29-12-11-13-31(22-29)48-32-16-17-34-33-14-9-10-15-37(33)46(38(34)23-32)39-24-30(47-8)18-19-43-39;1-40(2,3)34-15-11-16-35(41(4,5)6)39(34)27-25-43-44(26-27)28-12-10-13-30(22-28)47-31-18-19-33-32-14-8-9-17-36(32)45(37(33)23-31)38-24-29(46-7)20-21-42-38;;;;/h11-21,24-26H,1-10H3;10-21,24-26H,1-9H3;9-21,24-26H,1-8H3;8-21,24-26H,1-7H3;;;;/q4*-2;4*+2.
What are the key properties of 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))?
2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) has a molecular weight of 3339.60 g/mol, XLogP of 41.95, 24 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[4-(2,6-ditert-butyl-3,5-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-4-methylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-ditert-butyl-3,4,5-trimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) is sourced from PubChem (CID 160657190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).