C136H84N20Pt4S4 — CID 157122732
2-[2-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[2-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-4-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[4-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-2-pyridin-2-ylbenzene-3-id-1-yl]-1,3-thiazole;tetrakis(platinum(2+)) (PubChem CID 157122732) has the molecular formula C136H84N20Pt4S4 and a molecular weight of 2906.89 g/mol. Its IUPAC name is 2-[2-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[2-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-4-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[4-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-2-pyridin-2-ylbenzene-3-id-1-yl]-1,3-thiazole;tetrakis(platinum(2+)).
| Compound Name | 2-[2-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[2-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-4-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[4-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-2-pyridin-2-ylbenzene-3-id-1-yl]-1,3-thiazole;tetrakis(platinum(2+)) |
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| PubChem CID | 157122732 |
| Molecular Formula | C136H84N20Pt4S4 |
| Molecular Weight | 2906.89 g/mol |
| Exact Mass | 2904.47 |
| IUPAC Name | 2-[2-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[2-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-4-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[4-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-2-pyridin-2-ylbenzene-3-id-1-yl]-1,3-thiazole;tetrakis(platinum(2+)) |
| SMILES | Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3cc(-c4nccs4)ccn3)ccc2)nc2ccccc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccc(-c4nccs4)cn3)ccc2)nc2ccccc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccccn3)c(-c3nccs3)cc2)nc2ccccc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ncccc3-c3nccs3)ccc2)nc2ccccc21.[Pt+2].[Pt+2].[Pt+2].[Pt+2] |
| InChI | InChI=1S/4C34H21N5S.4Pt/c1-38-30-14-5-3-12-28(30)37-33(38)23-15-16-26-25-10-2-4-13-29(25)39(31(26)21-23)24-9-6-8-22(20-24)32-27(11-7-17-35-32)34-36-18-19-40-34;1-38-31-12-5-3-10-29(31)37-33(38)23-13-15-27-26-9-2-4-11-30(26)39(32(27)20-23)25-8-6-7-22(19-25)28-16-14-24(21-36-28)34-35-17-18-40-34;1-38-31-12-5-3-10-28(31)37-33(38)23-13-14-27-26-9-2-4-11-30(26)39(32(27)21-23)25-8-6-7-22(19-25)29-20-24(15-16-35-29)34-36-17-18-40-34;1-38-31-12-5-3-10-29(31)37-33(38)22-13-15-25-24-8-2-4-11-30(24)39(32(25)20-22)23-14-16-26(34-36-18-19-40-34)27(21-23)28-9-6-7-17-35-28;;;;/h2-19H,1H3;2-18,21H,1H3;2-18,20H,1H3;2-19H,1H3;;;;/q4*-2;4*+2 |
| InChIKey | GXSIVMMBVLLHGN-UHFFFAOYSA-N |
| XLogP | 32.48 |
| TPSA | 194.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 164 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2906.89 |
| LogP ≤ 5 | 32.48 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 24 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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