10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+))

C198H117N23O17Pd4Pt4S — CID 157388854

About 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+))

10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+)) (PubChem CID 157388854) has the molecular formula C198H117N23O17Pd4Pt4S and a molecular weight of 4328.32 g/mol. Its IUPAC name is 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+)).

Molecular Properties

• Compound Name: 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+))
• PubChem CID: 157388854
• Molecular Formula: C198H117N23O17Pd4Pt4S
• Molecular Weight: 4328.32 g/mol
• Exact Mass: 4323.34
• IUPAC Name: 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+))
• SMILES: CC(C)Cc1ccc(-c2cnc(-n3c4[c-]c(Oc5[c-]c(Oc6ccccn6)ccc5)ccc4c4ccc(Oc5[c-]c(Oc6ccccn6)ccc5)[c-]c43)nc2)cc1.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-n3c4ccccc4c4ccccc43)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(N3c4ccccc4Oc4ccccc43)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(N3c4ccccc4Sc4ccccc43)cn2)cccc1Oc1ccccn1
• InChI: InChI=1S/C50H28N6O5.C50H28N6O4S.C50H28N6O4.C48H33N5O4.4Pd.4Pt/c2*1-3-17-46-42(15-1)55(43-16-2-4-18-47(43)61-46)33-31-53-50(54-32-33)56-44-29-38(57-34-11-9-13-36(27-34)59-48-19-5-7-25-51-48)21-23-40(44)41-24-22-39(30-45(41)56)58-35-12-10-14-37(28-35)60-49-20-6-8-26-52-49;1-3-17-44-40(15-1)41-16-2-4-18-45(41)55(44)33-31-53-50(54-32-33)56-46-29-38(57-34-11-9-13-36(27-34)59-48-19-5-7-25-51-48)21-23-42(46)43-24-22-39(30-47(43)56)58-35-12-10-14-37(28-35)60-49-20-6-8-26-52-49;1-32(2)25-33-15-17-34(18-16-33)35-30-51-48(52-31-35)53-44-28-40(54-36-9-7-11-38(26-36)56-46-13-3-5-23-49-46)19-21-42(44)43-22-20-41(29-45(43)53)55-37-10-8-12-39(27-37)57-47-14-4-6-24-50-47;;;;;;;;/h2*1-26,31-32H;1-26,31-32H;3-24,30-32H,25H2,1-2H3;;;;;;;;/q4*-4;8*+2
• InChIKey: WRYFTQWZTBCTRA-UHFFFAOYSA-N
• XLogP: 48.39
• TPSA: 394.28 Ų
• H-Bond Acceptors: 41
• Rotatable Bonds: 42
• Heavy Atoms: 247
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4328.32
LogP ≤ 5	48.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+))?

The IUPAC name of 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+)) (CID 157388854) is 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+)).

What is the SMILES notation for 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+))?

The canonical SMILES for 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+)) is CC(C)Cc1ccc(-c2cnc(-n3c4[c-]c(Oc5[c-]c(Oc6ccccn6)ccc5)ccc4c4ccc(Oc5[c-]c(Oc6ccccn6)ccc5)[c-]c43)nc2)cc1.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-n3c4ccccc4c4ccccc43)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(N3c4ccccc4Oc4ccccc43)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(N3c4ccccc4Sc4ccccc43)cn2)cccc1Oc1ccccn1.

What is the InChIKey of 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+))?

The InChIKey is WRYFTQWZTBCTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H28N6O5.C50H28N6O4S.C50H28N6O4.C48H33N5O4.4Pd.4Pt/c2*1-3-17-46-42(15-1)55(43-16-2-4-18-47(43)61-46)33-31-53-50(54-32-33)56-44-29-38(57-34-11-9-13-36(27-34)59-48-19-5-7-25-51-48)21-23-40(44)41-24-22-39(30-45(41)56)58-35-12-10-14-37(28-35)60-49-20-6-8-26-52-49;1-3-17-44-40(15-1)41-16-2-4-18-45(41)55(44)33-31-53-50(54-32-33)56-46-29-38(57-34-11-9-13-36(27-34)59-48-19-5-7-25-51-48)21-23-42(46)43-24-22-39(30-47(43)56)58-35-12-10-14-37(28-35)60-49-20-6-8-26-52-49;1-32(2)25-33-15-17-34(18-16-33)35-30-51-48(52-31-35)53-44-28-40(54-36-9-7-11-38(26-36)56-46-13-3-5-23-49-46)19-21-42(44)43-22-20-41(29-45(43)53)55-37-10-8-12-39(27-37)57-47-14-4-6-24-50-47;;;;;;;;/h2*1-26,31-32H;1-26,31-32H;3-24,30-32H,25H2,1-2H3;;;;;;;;/q4*-4;8*+2.

What are the key properties of 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+))?

10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+)) has a molecular weight of 4328.32 g/mol, XLogP of 48.39, 42 rotatable bonds, 0 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenothiazine;10-[2-[2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;9-(5-carbazol-9-ylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-[4-(2-methylpropyl)phenyl]pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;tetrakis(palladium(2+));tetrakis(platinum(2+)) is sourced from PubChem (CID 157388854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).