2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))

C164H89F5N20O16Pt8 — CID 161473842

About 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))

2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) (PubChem CID 161473842) has the molecular formula C164H89F5N20O16Pt8 and a molecular weight of 4251.25 g/mol. Its IUPAC name is 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)).

Molecular Properties

• Compound Name: 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))
• PubChem CID: 161473842
• Molecular Formula: C164H89F5N20O16Pt8
• Molecular Weight: 4251.25 g/mol
• Exact Mass: 4248.39
• IUPAC Name: 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))
• SMILES: FC(F)(F)c1cnc(-n2c3[c-]c(Oc4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c32)nc1.FC(F)c1cnc(-n2c3[c-]c(Oc4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c32)nc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-c3ccccc3)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc3ccccc3n2)cccc1Oc1ccccn1
• InChI: InChI=1S/C44H25N5O4.C42H23N5O4.C39H20F3N5O4.C39H21F2N5O4.8Pt/c1-2-10-30(11-3-1)31-28-47-44(48-29-31)49-40-26-36(50-32-12-8-14-34(24-32)52-42-16-4-6-22-45-42)18-20-38(40)39-21-19-37(27-41(39)49)51-33-13-9-15-35(25-33)53-43-17-5-7-23-46-43;1-2-14-37-28(9-1)27-45-42(46-37)47-38-25-33(48-29-10-7-12-31(23-29)50-40-15-3-5-21-43-40)17-19-35(38)36-20-18-34(26-39(36)47)49-30-11-8-13-32(24-30)51-41-16-4-6-22-44-41;40-39(41,42)25-23-45-38(46-24-25)47-34-21-30(48-26-7-5-9-28(19-26)50-36-11-1-3-17-43-36)13-15-32(34)33-16-14-31(22-35(33)47)49-27-8-6-10-29(20-27)51-37-12-2-4-18-44-37;40-38(41)25-23-44-39(45-24-25)46-34-21-30(47-26-7-5-9-28(19-26)49-36-11-1-3-17-42-36)13-15-32(34)33-16-14-31(22-35(33)46)48-27-8-6-10-29(20-27)50-37-12-2-4-18-43-37;;;;;;;;/h1-23,28-29H;1-22,27H;1-18,23-24H;1-18,23-24,38H;;;;;;;;/q4*-4;8*+2
• InChIKey: XZHFLNJTKHFSCY-UHFFFAOYSA-N
• XLogP: 39.69
• TPSA: 373.64 Ų
• H-Bond Acceptors: 36
• Rotatable Bonds: 38
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4251.25
LogP ≤ 5	39.69
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))?

The IUPAC name of 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) (CID 161473842) is 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)).

What is the SMILES notation for 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))?

The canonical SMILES for 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) is FC(F)(F)c1cnc(-n2c3[c-]c(Oc4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c32)nc1.FC(F)c1cnc(-n2c3[c-]c(Oc4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c32)nc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-c3ccccc3)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc3ccccc3n2)cccc1Oc1ccccn1.

What is the InChIKey of 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))?

The InChIKey is XZHFLNJTKHFSCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H25N5O4.C42H23N5O4.C39H20F3N5O4.C39H21F2N5O4.8Pt/c1-2-10-30(11-3-1)31-28-47-44(48-29-31)49-40-26-36(50-32-12-8-14-34(24-32)52-42-16-4-6-22-45-42)18-20-38(40)39-21-19-37(27-41(39)49)51-33-13-9-15-35(25-33)53-43-17-5-7-23-46-43;1-2-14-37-28(9-1)27-45-42(46-37)47-38-25-33(48-29-10-7-12-31(23-29)50-40-15-3-5-21-43-40)17-19-35(38)36-20-18-34(26-39(36)47)49-30-11-8-13-32(24-30)51-41-16-4-6-22-44-41;40-39(41,42)25-23-45-38(46-24-25)47-34-21-30(48-26-7-5-9-28(19-26)50-36-11-1-3-17-43-36)13-15-32(34)33-16-14-31(22-35(33)47)49-27-8-6-10-29(20-27)51-37-12-2-4-18-44-37;40-38(41)25-23-44-39(45-24-25)46-34-21-30(47-26-7-5-9-28(19-26)49-36-11-1-3-17-42-36)13-15-32(34)33-16-14-31(22-35(33)46)48-27-8-6-10-29(20-27)50-37-12-2-4-18-43-37;;;;;;;;/h1-23,28-29H;1-22,27H;1-18,23-24H;1-18,23-24,38H;;;;;;;;/q4*-4;8*+2.

What are the key properties of 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))?

2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) has a molecular weight of 4251.25 g/mol, XLogP of 39.69, 38 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-quinazolin-2-yl-1,8-dihydrocarbazole-1,8-diide;2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-[5-(trifluoromethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-[5-(difluoromethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-phenylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) is sourced from PubChem (CID 161473842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).