2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))

C148H116F4N16O4Pt4 — CID 161268884

IUPAC2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))
SMILESCCCc1cc(C)c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(F)ccn4)ccc3)c2)c(C)c1.CCc1cc(C)c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(F)ccn4)ccc3)c2)c(C)c1.Cc1cc(C(C)(C)C)cc(C)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(F)ccn3)ccc2)c1.Cc1cc(C(C)C)cc(C)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(F)ccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C38H31FN4O.2C37H29FN4O.C36H27FN4O.4Pt/c1-24-17-27(38(3,4)5)18-25(2)37(24)26-22-41-42(23-26)29-9-8-10-30(20-29)44-31-13-14-33-32-11-6-7-12-34(32)43(35(33)21-31)36-19-28(39)15-16-40-36;1-23(2)26-16-24(3)37(25(4)17-26)27-21-40-41(22-27)29-8-7-9-30(19-29)43-31-12-13-33-32-10-5-6-11-34(32)42(35(33)20-31)36-18-28(38)14-15-39-36;1-4-8-26-17-24(2)37(25(3)18-26)27-22-40-41(23-27)29-9-7-10-30(20-29)43-31-13-14-33-32-11-5-6-12-34(32)42(35(33)21-31)36-19-28(38)15-16-39-36;1-4-25-16-23(2)36(24(3)17-25)26-21-39-40(22-26)28-8-7-9-29(19-28)42-30-12-13-32-31-10-5-6-11-33(31)41(34(32)20-30)35-18-27(37)14-15-38-35;;;;/h6-19,22-23H,1-5H3;5-18,21-23H,1-4H3;5-7,9-19,22-23H,4,8H2,1-3H3;5-18,21-22H,4H2,1-3H3;;;;/q4*-2;4*+2
InChIKeyJCIYFGHCAXVMMI-UHFFFAOYSA-N
MW3038.97 g/mol
LogP36.65
Rot. Bonds24

About 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))

2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) (PubChem CID 161268884) has the molecular formula C148H116F4N16O4Pt4 and a molecular weight of 3038.97 g/mol. Its IUPAC name is 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)).

Molecular Properties

Compound Name2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))
PubChem CID161268884
Molecular FormulaC148H116F4N16O4Pt4
Molecular Weight3038.97 g/mol
Exact Mass3036.79
IUPAC Name2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))
SMILESCCCc1cc(C)c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(F)ccn4)ccc3)c2)c(C)c1.CCc1cc(C)c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(F)ccn4)ccc3)c2)c(C)c1.Cc1cc(C(C)(C)C)cc(C)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(F)ccn3)ccc2)c1.Cc1cc(C(C)C)cc(C)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(F)ccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C38H31FN4O.2C37H29FN4O.C36H27FN4O.4Pt/c1-24-17-27(38(3,4)5)18-25(2)37(24)26-22-41-42(23-26)29-9-8-10-30(20-29)44-31-13-14-33-32-11-6-7-12-34(32)43(35(33)21-31)36-19-28(39)15-16-40-36;1-23(2)26-16-24(3)37(25(4)17-26)27-21-40-41(22-27)29-8-7-9-30(19-29)43-31-12-13-33-32-10-5-6-11-34(32)42(35(33)20-31)36-18-28(38)14-15-39-36;1-4-8-26-17-24(2)37(25(3)18-26)27-22-40-41(23-27)29-9-7-10-30(20-29)43-31-13-14-33-32-11-5-6-12-34(32)42(35(33)21-31)36-19-28(38)15-16-39-36;1-4-25-16-23(2)36(24(3)17-25)26-21-39-40(22-26)28-8-7-9-29(19-28)42-30-12-13-32-31-10-5-6-11-33(31)41(34(32)20-30)35-18-27(37)14-15-38-35;;;;/h6-19,22-23H,1-5H3;5-18,21-23H,1-4H3;5-7,9-19,22-23H,4,8H2,1-3H3;5-18,21-22H,4H2,1-3H3;;;;/q4*-2;4*+2
InChIKeyJCIYFGHCAXVMMI-UHFFFAOYSA-N
XLogP36.65
TPSA179.48 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds24
Heavy Atoms176
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003038.97
LogP ≤ 536.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-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-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The IUPAC name of 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) (CID 161268884) is 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)).
What is the SMILES notation for 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The canonical SMILES for 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) is CCCc1cc(C)c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(F)ccn4)ccc3)c2)c(C)c1.CCc1cc(C)c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(F)ccn4)ccc3)c2)c(C)c1.Cc1cc(C(C)(C)C)cc(C)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(F)ccn3)ccc2)c1.Cc1cc(C(C)C)cc(C)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(F)ccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The InChIKey is JCIYFGHCAXVMMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H31FN4O.2C37H29FN4O.C36H27FN4O.4Pt/c1-24-17-27(38(3,4)5)18-25(2)37(24)26-22-41-42(23-26)29-9-8-10-30(20-29)44-31-13-14-33-32-11-6-7-12-34(32)43(35(33)21-31)36-19-28(39)15-16-40-36;1-23(2)26-16-24(3)37(25(4)17-26)27-21-40-41(22-27)29-8-7-9-30(19-29)43-31-12-13-33-32-10-5-6-11-34(32)42(35(33)20-31)36-18-28(38)14-15-39-36;1-4-8-26-17-24(2)37(25(3)18-26)27-22-40-41(23-27)29-9-7-10-30(20-29)43-31-13-14-33-32-11-5-6-12-34(32)42(35(33)21-31)36-19-28(38)15-16-39-36;1-4-25-16-23(2)36(24(3)17-25)26-21-39-40(22-26)28-8-7-9-29(19-28)42-30-12-13-32-31-10-5-6-11-33(31)41(34(32)20-30)35-18-27(37)14-15-38-35;;;;/h6-19,22-23H,1-5H3;5-18,21-23H,1-4H3;5-7,9-19,22-23H,4,8H2,1-3H3;5-18,21-22H,4H2,1-3H3;;;;/q4*-2;4*+2.
What are the key properties of 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+))?
2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) has a molecular weight of 3038.97 g/mol, XLogP of 36.65, 24 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[4-(4-tert-butyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propan-2-ylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(2,6-dimethyl-4-propylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;2-[3-[4-(4-ethyl-2,6-dimethylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-fluoro-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) is sourced from PubChem (CID 161268884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).