bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))

C192H208N16O4Pt4 — CID 162035034

IUPACbis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))
SMILESCCCc1c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C)ccn4)ccc3)c2)c(CCC)c(C(C)(C)C)c(C(C)(C)C)c1C(C)(C)C.CCCc1c(C(C)(C)C)cc(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.CCCc1cc(C(C)(C)C)c(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.CCCc1cc(C(C)(C)C)c(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C51H58N4O.3C47H50N4O.4Pt/c1-13-18-40-45(41(19-14-2)47(50(7,8)9)48(51(10,11)12)46(40)49(4,5)6)34-31-53-54(32-34)35-20-17-21-36(29-35)56-37-24-25-39-38-22-15-16-23-42(38)55(43(39)30-37)44-28-33(3)26-27-52-44;1-10-15-38-40(46(4,5)6)28-41(47(7,8)9)39(16-11-2)45(38)32-29-49-50(30-32)33-17-14-18-34(26-33)52-35-21-22-37-36-19-12-13-20-42(36)51(43(37)27-35)44-25-31(3)23-24-48-44;2*1-10-15-32-26-40(46(4,5)6)45(47(7,8)9)39(16-11-2)44(32)33-29-49-50(30-33)34-17-14-18-35(27-34)52-36-21-22-38-37-19-12-13-20-41(37)51(42(38)28-36)43-25-31(3)23-24-48-43;;;;/h15-17,20-28,31-32H,13-14,18-19H2,1-12H3;12-14,17-25,28-30H,10-11,15-16H2,1-9H3;2*12-14,17-26,29-30H,10-11,15-16H2,1-9H3;;;;/q4*-2;4*+2
InChIKeyNFWHMRMFVLNTCS-UHFFFAOYSA-N
MW3584.20 g/mol
LogP50.22
Rot. Bonds36

About bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))

bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+)) (PubChem CID 162035034) has the molecular formula C192H208N16O4Pt4 and a molecular weight of 3584.20 g/mol. Its IUPAC name is bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+)).

Molecular Properties

Compound Namebis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))
PubChem CID162035034
Molecular FormulaC192H208N16O4Pt4
Molecular Weight3584.20 g/mol
Exact Mass3581.52
IUPAC Namebis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))
SMILESCCCc1c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C)ccn4)ccc3)c2)c(CCC)c(C(C)(C)C)c(C(C)(C)C)c1C(C)(C)C.CCCc1c(C(C)(C)C)cc(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.CCCc1cc(C(C)(C)C)c(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.CCCc1cc(C(C)(C)C)c(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C51H58N4O.3C47H50N4O.4Pt/c1-13-18-40-45(41(19-14-2)47(50(7,8)9)48(51(10,11)12)46(40)49(4,5)6)34-31-53-54(32-34)35-20-17-21-36(29-35)56-37-24-25-39-38-22-15-16-23-42(38)55(43(39)30-37)44-28-33(3)26-27-52-44;1-10-15-38-40(46(4,5)6)28-41(47(7,8)9)39(16-11-2)45(38)32-29-49-50(30-32)33-17-14-18-34(26-33)52-35-21-22-37-36-19-12-13-20-42(36)51(43(37)27-35)44-25-31(3)23-24-48-44;2*1-10-15-32-26-40(46(4,5)6)45(47(7,8)9)39(16-11-2)44(32)33-29-49-50(30-33)34-17-14-18-35(27-34)52-36-21-22-38-37-19-12-13-20-41(37)51(42(38)28-36)43-25-31(3)23-24-48-43;;;;/h15-17,20-28,31-32H,13-14,18-19H2,1-12H3;12-14,17-25,28-30H,10-11,15-16H2,1-9H3;2*12-14,17-26,29-30H,10-11,15-16H2,1-9H3;;;;/q4*-2;4*+2
InChIKeyNFWHMRMFVLNTCS-UHFFFAOYSA-N
XLogP50.22
TPSA179.48 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds36
Heavy Atoms216
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003584.20
LogP ≤ 550.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The IUPAC name of bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+)) (CID 162035034) is bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+)).
What is the SMILES notation for bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The canonical SMILES for bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+)) is CCCc1c(-c2cnn(-c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C)ccn4)ccc3)c2)c(CCC)c(C(C)(C)C)c(C(C)(C)C)c1C(C)(C)C.CCCc1c(C(C)(C)C)cc(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.CCCc1cc(C(C)(C)C)c(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.CCCc1cc(C(C)(C)C)c(C(C)(C)C)c(CCC)c1-c1cnn(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))?
The InChIKey is NFWHMRMFVLNTCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H58N4O.3C47H50N4O.4Pt/c1-13-18-40-45(41(19-14-2)47(50(7,8)9)48(51(10,11)12)46(40)49(4,5)6)34-31-53-54(32-34)35-20-17-21-36(29-35)56-37-24-25-39-38-22-15-16-23-42(38)55(43(39)30-37)44-28-33(3)26-27-52-44;1-10-15-38-40(46(4,5)6)28-41(47(7,8)9)39(16-11-2)45(38)32-29-49-50(30-32)33-17-14-18-34(26-33)52-35-21-22-37-36-19-12-13-20-42(36)51(43(37)27-35)44-25-31(3)23-24-48-44;2*1-10-15-32-26-40(46(4,5)6)45(47(7,8)9)39(16-11-2)44(32)33-29-49-50(30-33)34-17-14-18-35(27-34)52-36-21-22-38-37-19-12-13-20-41(37)51(42(38)28-36)43-25-31(3)23-24-48-43;;;;/h15-17,20-28,31-32H,13-14,18-19H2,1-12H3;12-14,17-25,28-30H,10-11,15-16H2,1-9H3;2*12-14,17-26,29-30H,10-11,15-16H2,1-9H3;;;;/q4*-2;4*+2.
What are the key properties of bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+))?
bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+)) has a molecular weight of 3584.20 g/mol, XLogP of 50.22, 36 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-[3-[4-(3,4-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide);2-[3-[4-(3,5-ditert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[4-(3,4,5-tritert-butyl-2,6-dipropylphenyl)pyrazol-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;tetrakis(platinum(2+)) is sourced from PubChem (CID 162035034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).