9-(5,6-dimethyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(6-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(5-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+))
C177H120N18Pt6S6 — CID 159724579
Data last refreshed: (MolForge compound catalog, from PubChem)
About 9-(5,6-dimethyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(6-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(5-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+))
9-(5,6-dimethyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(6-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(5-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+)) (PubChem CID 159724579) has the molecular formula C177H120N18Pt6S6 and a molecular weight of 3861.90 g/mol. Its IUPAC name is 9-(5,6-dimethyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(6-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(5-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+)).
Molecular Properties
| Compound Name | 9-(5,6-dimethyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(6-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(5-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+)) |
|---|---|
| PubChem CID | 159724579 |
| Molecular Formula | C177H120N18Pt6S6 |
| Molecular Weight | 3861.90 g/mol |
| Exact Mass | 3858.62 |
| IUPAC Name | 9-(5,6-dimethyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-[3-[(6-methyl-2-pyridinyl)sulfanyl]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(3-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(5-methyl-2-pyridinyl)-2-(3-pyridin-2-ylsulfanylbenzene-2-id-1-yl)-1H-carbazol-1-ide;hexakis(platinum(2+)) |
| SMILES | Cc1ccc(-n2c3[c-]c(-c4[c-]c(Sc5ccccn5)ccc4)ccc3c3ccccc32)nc1.Cc1ccc(-n2c3[c-]c(-c4[c-]c(Sc5ccccn5)ccc4)ccc3c3ccccc32)nc1C.Cc1cccnc1-n1c2[c-]c(-c3[c-]c(Sc4ccccn4)ccc3)ccc2c2ccccc21.Cc1ccnc(-n2c3[c-]c(-c4[c-]c(Sc5cccc(C)n5)ccc4)ccc3c3ccccc32)c1.Cc1ccnc(-n2c3[c-]c(-c4[c-]c(Sc5ccccn5)ccc4)ccc3c3ccccc32)c1.Cc1ccnc(Sc2[c-]c(-c3[c-]c4c(cc3)c3ccccc3n4-c3cc(C)ccn3)ccc2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2] |
| InChI | InChI=1S/3C30H21N3S.3C29H19N3S.6Pt/c1-20-15-16-31-29(17-20)33-27-11-4-3-10-25(27)26-14-13-23(19-28(26)33)22-8-6-9-24(18-22)34-30-12-5-7-21(2)32-30;1-20-13-16-29(32-21(20)2)33-27-11-4-3-10-25(27)26-15-14-23(19-28(26)33)22-8-7-9-24(18-22)34-30-12-5-6-17-31-30;1-20-12-14-31-29(16-20)33-27-9-4-3-8-25(27)26-11-10-23(19-28(26)33)22-6-5-7-24(18-22)34-30-17-21(2)13-15-32-30;1-20-8-7-17-31-29(20)32-26-12-3-2-11-24(26)25-15-14-22(19-27(25)32)21-9-6-10-23(18-21)33-28-13-4-5-16-30-28;1-20-12-15-28(31-19-20)32-26-10-3-2-9-24(26)25-14-13-22(18-27(25)32)21-7-6-8-23(17-21)33-29-11-4-5-16-30-29;1-20-14-16-30-28(17-20)32-26-10-3-2-9-24(26)25-13-12-22(19-27(25)32)21-7-6-8-23(18-21)33-29-11-4-5-15-31-29;;;;;;/h3*3-17H,1-2H3;2-17H,1H3;2-16,19H,1H3;2-17H,1H3;;;;;;/q6*-2;6*+2 |
| InChIKey | NAZVHHQQMNWGGL-UHFFFAOYSA-N |
| XLogP | 44.71 |
| TPSA | 184.26 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 207 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3861.90 |
| LogP ≤ 5 | 44.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 24 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
|---|
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Sources
- PubChem CID 159724579 — identifiers, structure, computed properties (public domain)
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