10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+))

C153H90N18O7Pt6S — CID 160612513

About 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+))

10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+)) (PubChem CID 160612513) has the molecular formula C153H90N18O7Pt6S and a molecular weight of 3495.06 g/mol. Its IUPAC name is 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+)).

Molecular Properties

• Compound Name: 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+))
• PubChem CID: 160612513
• Molecular Formula: C153H90N18O7Pt6S
• Molecular Weight: 3495.06 g/mol
• Exact Mass: 3492.48
• IUPAC Name: 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+))
• SMILES: CC1(C)c2ccccc2N(c2cnc(-n3c4[c-]c(Oc5[c-]c(-c6ccccn6)ccc5)ccc4c4ccc(Oc5[c-]c(-c6ccccn6)ccc5)[c-]c43)nc2)c2ccccc21.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c2n3-c2ncc(N3c4ccccc4Oc4ccccc43)cn2)cccc1-c1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c2n3-c2ncc(N3c4ccccc4Sc4ccccc43)cn2)cccc1-c1ccccn1
• InChI: InChI=1S/C53H34N6O2.C50H28N6O3.C50H28N6O2S.6Pt/c1-53(2)44-17-3-5-21-48(44)58(49-22-6-4-18-45(49)53)37-33-56-52(57-34-37)59-50-31-40(60-38-15-11-13-35(29-38)46-19-7-9-27-54-46)23-25-42(50)43-26-24-41(32-51(43)59)61-39-16-12-14-36(30-39)47-20-8-10-28-55-47;2*1-3-19-48-44(17-1)55(45-18-2-4-20-49(45)59-48)35-31-53-50(54-32-35)56-46-29-38(57-36-13-9-11-33(27-36)42-15-5-7-25-51-42)21-23-40(46)41-24-22-39(30-47(41)56)58-37-14-10-12-34(28-37)43-16-6-8-26-52-43;;;;;;/h3-28,33-34H,1-2H3;2*1-26,31-32H;;;;;;/q3*-4;6*+2
• InChIKey: YVEGEYQXVAFHFL-UHFFFAOYSA-N
• XLogP: 37.05
• TPSA: 243.80 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 24
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3495.06
LogP ≤ 5	37.05
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+))?

The IUPAC name of 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+)) (CID 160612513) is 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+)).

What is the SMILES notation for 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+))?

The canonical SMILES for 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+)) is CC1(C)c2ccccc2N(c2cnc(-n3c4[c-]c(Oc5[c-]c(-c6ccccn6)ccc5)ccc4c4ccc(Oc5[c-]c(-c6ccccn6)ccc5)[c-]c43)nc2)c2ccccc21.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c2n3-c2ncc(N3c4ccccc4Oc4ccccc43)cn2)cccc1-c1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c2n3-c2ncc(N3c4ccccc4Sc4ccccc43)cn2)cccc1-c1ccccn1.

What is the InChIKey of 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+))?

The InChIKey is YVEGEYQXVAFHFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H34N6O2.C50H28N6O3.C50H28N6O2S.6Pt/c1-53(2)44-17-3-5-21-48(44)58(49-22-6-4-18-45(49)53)37-33-56-52(57-34-37)59-50-31-40(60-38-15-11-13-35(29-38)46-19-7-9-27-54-46)23-25-42(50)43-26-24-41(32-51(43)59)61-39-16-12-14-36(30-39)47-20-8-10-28-55-47;2*1-3-19-48-44(17-1)55(45-18-2-4-20-49(45)59-48)35-31-53-50(54-32-35)56-46-29-38(57-36-13-9-11-33(27-36)42-15-5-7-25-51-42)21-23-40(46)41-24-22-39(30-47(41)56)58-37-14-10-12-34(28-37)43-16-6-8-26-52-43;;;;;;/h3-28,33-34H,1-2H3;2*1-26,31-32H;;;;;;/q3*-4;6*+2.

What are the key properties of 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+))?

10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+)) has a molecular weight of 3495.06 g/mol, XLogP of 37.05, 24 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]-9,9-dimethylacridine;10-[2-[2,7-bis[(3-pyridin-2-ylbenzene-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-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diid-9-yl]pyrimidin-5-yl]phenoxazine;hexakis(platinum(2+)) is sourced from PubChem (CID 160612513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).