C136H76N12O4Pt4S4 — CID 158626404
2-[4-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[5-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[7-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[8-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;tetrakis(platinum(2+)) (PubChem CID 158626404) has the molecular formula C136H76N12O4Pt4S4 and a molecular weight of 2850.76 g/mol. Its IUPAC name is 2-[4-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[5-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[7-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[8-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;tetrakis(platinum(2+)).
| Compound Name | 2-[4-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[5-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[7-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[8-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;tetrakis(platinum(2+)) |
|---|---|
| PubChem CID | 158626404 |
| Molecular Formula | C136H76N12O4Pt4S4 |
| Molecular Weight | 2850.76 g/mol |
| Exact Mass | 2848.36 |
| IUPAC Name | 2-[4-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[5-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[7-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[8-(furan-3-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;tetrakis(platinum(2+)) |
| SMILES | [Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)cc(-c3ccoc3)c2c2ccccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2c(-c3ccoc3)cccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccc(-c3ccoc3)cc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2cccc(-c3ccoc3)c21 |
| InChI | InChI=1S/4C34H19N3OS.4Pt/c1-3-13-30-26(10-1)33-27(23-15-17-38-21-23)19-24(34-36-29-12-2-4-14-32(29)39-34)20-31(33)37(30)25-9-7-8-22(18-25)28-11-5-6-16-35-28;1-2-13-32-30(12-1)36-34(39-32)23-14-15-27-28-10-6-9-26(24-16-18-38-21-24)33(28)37(31(27)20-23)25-8-5-7-22(19-25)29-11-3-4-17-35-29;1-2-13-32-29(11-1)36-34(39-32)23-14-15-27-31(20-23)37(25-8-5-7-22(19-25)28-10-3-4-17-35-28)30-12-6-9-26(33(27)30)24-16-18-38-21-24;1-2-10-33-30(9-1)36-34(39-33)24-12-14-28-27-13-11-22(25-15-17-38-21-25)19-31(27)37(32(28)20-24)26-7-5-6-23(18-26)29-8-3-4-16-35-29;;;;/h1-17,19,21H;2*1-18,21H;1-17,19,21H;;;;/q4*-2;4*+2 |
| InChIKey | YCEJLUQASKELBN-UHFFFAOYSA-N |
| XLogP | 35.92 |
| TPSA | 175.40 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 20 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 160 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2850.76 |
| LogP ≤ 5 | 35.92 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 20 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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