2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))

C154H118N20O5Pt5 — CID 158801684

IUPAC2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))
SMILESCC(C)(C)c1ccc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncc(C(C)(C)C)cn3)ccc2)nc1.CC(C)(C)c1cnc(-n2c3[c-]c(-c4[c-]c(Oc5cc(C(C)(C)C)ccn5)ccc4)ccc3c3ccccc32)nc1.Cc1ccc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccn3)ccc2)nc1.Cc1cccnc1Oc1[c-]c(-c2[c-]c3c(cc2)c2ccccc2n3-c2ncccn2)ccc1.Cc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/2C35H32N4O.3C28H18N4O.5Pt/c1-34(2,3)25-15-17-32(36-20-25)40-27-11-9-10-23(18-27)24-14-16-29-28-12-7-8-13-30(28)39(31(29)19-24)33-37-21-26(22-38-33)35(4,5)6;1-34(2,3)25-16-17-36-32(20-25)40-27-11-9-10-23(18-27)24-14-15-29-28-12-7-8-13-30(28)39(31(29)19-24)33-37-21-26(22-38-33)35(4,5)6;1-19-7-5-14-29-27(19)33-22-9-4-8-20(17-22)21-12-13-24-23-10-2-3-11-25(23)32(26(24)18-21)28-30-15-6-16-31-28;1-19-10-13-27(31-18-19)33-22-7-4-6-20(16-22)21-11-12-24-23-8-2-3-9-25(23)32(26(24)17-21)28-29-14-5-15-30-28;1-19-12-15-29-27(16-19)33-22-7-4-6-20(17-22)21-10-11-24-23-8-2-3-9-25(23)32(26(24)18-21)28-30-13-5-14-31-28;;;;;/h2*7-17,20-22H,1-6H3;2-16H,1H3;2-15,18H,1H3;2-16H,1H3;;;;;/q5*-2;5*+2
InChIKeyHQHGQOKAURBCBP-UHFFFAOYSA-N
MW3304.16 g/mol
LogP36.24
Rot. Bonds20

About 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))

2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+)) (PubChem CID 158801684) has the molecular formula C154H118N20O5Pt5 and a molecular weight of 3304.16 g/mol. Its IUPAC name is 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+)).

Molecular Properties

Compound Name2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))
PubChem CID158801684
Molecular FormulaC154H118N20O5Pt5
Molecular Weight3304.16 g/mol
Exact Mass3301.78
IUPAC Name2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))
SMILESCC(C)(C)c1ccc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncc(C(C)(C)C)cn3)ccc2)nc1.CC(C)(C)c1cnc(-n2c3[c-]c(-c4[c-]c(Oc5cc(C(C)(C)C)ccn5)ccc4)ccc3c3ccccc32)nc1.Cc1ccc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccn3)ccc2)nc1.Cc1cccnc1Oc1[c-]c(-c2[c-]c3c(cc2)c2ccccc2n3-c2ncccn2)ccc1.Cc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/2C35H32N4O.3C28H18N4O.5Pt/c1-34(2,3)25-15-17-32(36-20-25)40-27-11-9-10-23(18-27)24-14-16-29-28-12-7-8-13-30(28)39(31(29)19-24)33-37-21-26(22-38-33)35(4,5)6;1-34(2,3)25-16-17-36-32(20-25)40-27-11-9-10-23(18-27)24-14-15-29-28-12-7-8-13-30(28)39(31(29)19-24)33-37-21-26(22-38-33)35(4,5)6;1-19-7-5-14-29-27(19)33-22-9-4-8-20(17-22)21-12-13-24-23-10-2-3-11-25(23)32(26(24)18-21)28-30-15-6-16-31-28;1-19-10-13-27(31-18-19)33-22-7-4-6-20(16-22)21-11-12-24-23-8-2-3-9-25(23)32(26(24)17-21)28-29-14-5-15-30-28;1-19-12-15-29-27(16-19)33-22-7-4-6-20(17-22)21-10-11-24-23-8-2-3-9-25(23)32(26(24)18-21)28-30-13-5-14-31-28;;;;;/h2*7-17,20-22H,1-6H3;2-16H,1H3;2-15,18H,1H3;2-16H,1H3;;;;;/q5*-2;5*+2
InChIKeyHQHGQOKAURBCBP-UHFFFAOYSA-N
XLogP36.24
TPSA264.15 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds20
Heavy Atoms184
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003304.16
LogP ≤ 536.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+)) with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))?
The IUPAC name of 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+)) (CID 158801684) is 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+)).
What is the SMILES notation for 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))?
The canonical SMILES for 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+)) is CC(C)(C)c1ccc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncc(C(C)(C)C)cn3)ccc2)nc1.CC(C)(C)c1cnc(-n2c3[c-]c(-c4[c-]c(Oc5cc(C(C)(C)C)ccn5)ccc4)ccc3c3ccccc32)nc1.Cc1ccc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccn3)ccc2)nc1.Cc1cccnc1Oc1[c-]c(-c2[c-]c3c(cc2)c2ccccc2n3-c2ncccn2)ccc1.Cc1ccnc(Oc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3ncccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))?
The InChIKey is HQHGQOKAURBCBP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C35H32N4O.3C28H18N4O.5Pt/c1-34(2,3)25-15-17-32(36-20-25)40-27-11-9-10-23(18-27)24-14-16-29-28-12-7-8-13-30(28)39(31(29)19-24)33-37-21-26(22-38-33)35(4,5)6;1-34(2,3)25-16-17-36-32(20-25)40-27-11-9-10-23(18-27)24-14-15-29-28-12-7-8-13-30(28)39(31(29)19-24)33-37-21-26(22-38-33)35(4,5)6;1-19-7-5-14-29-27(19)33-22-9-4-8-20(17-22)21-12-13-24-23-10-2-3-11-25(23)32(26(24)18-21)28-30-15-6-16-31-28;1-19-10-13-27(31-18-19)33-22-7-4-6-20(16-22)21-11-12-24-23-8-2-3-9-25(23)32(26(24)17-21)28-29-14-5-15-30-28;1-19-12-15-29-27(16-19)33-22-7-4-6-20(17-22)21-10-11-24-23-8-2-3-9-25(23)32(26(24)18-21)28-30-13-5-14-31-28;;;;;/h2*7-17,20-22H,1-6H3;2-16H,1H3;2-15,18H,1H3;2-16H,1H3;;;;;/q5*-2;5*+2.
What are the key properties of 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+))?
2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+)) has a molecular weight of 3304.16 g/mol, XLogP of 36.24, 20 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(4-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(5-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-(5-tert-butylpyrimidin-2-yl)-1H-carbazol-1-ide;2-[3-[(3-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(4-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;2-[3-[(5-methyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyrimidin-2-yl-1H-carbazol-1-ide;pentakis(platinum(2+)) is sourced from PubChem (CID 158801684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).