C128H73N12Pt3S3-3 — CID 157181776
5-carbazol-9-yl-2-[9-(9-phenyl-1,9-dihydrofluoren-1-id-2-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;5-carbazol-9-yl-2-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]-1,3-thiazole;5-carbazol-9-yl-2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;platinum;bis(platinum(2+)) (PubChem CID 157181776) has the molecular formula C128H73N12Pt3S3-3 and a molecular weight of 2460.51 g/mol. Its IUPAC name is 5-carbazol-9-yl-2-[9-(9-phenyl-1,9-dihydrofluoren-1-id-2-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;5-carbazol-9-yl-2-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]-1,3-thiazole;5-carbazol-9-yl-2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;platinum;bis(platinum(2+)).
| Compound Name | 5-carbazol-9-yl-2-[9-(9-phenyl-1,9-dihydrofluoren-1-id-2-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;5-carbazol-9-yl-2-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]-1,3-thiazole;5-carbazol-9-yl-2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;platinum;bis(platinum(2+)) |
|---|---|
| PubChem CID | 157181776 |
| Molecular Formula | C128H73N12Pt3S3-3 |
| Molecular Weight | 2460.51 g/mol |
| Exact Mass | 2458.42 |
| IUPAC Name | 5-carbazol-9-yl-2-[9-(9-phenyl-1,9-dihydrofluoren-1-id-2-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;5-carbazol-9-yl-2-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]-1,3-thiazole;5-carbazol-9-yl-2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;platinum;bis(platinum(2+)) |
| SMILES | [Pt+2].[Pt+2].[Pt].[c-]1c(-c2ncc(-n3c4ccccc4c4ccccc43)s2)cccc1-n1c2[c-]c(-c3ccccn3)ccc2c2ccccc21.[c-]1c(-n2c3[c-]c(-c4ncc(-n5c6ccccc6c6ccccc65)s4)ccc3c3ccccc32)cccc1-n1c2ccccc2c2cccnc21.[c-]1ccccc1C1c2[c-]c(-n3c4[c-]c(-c5ncc(-n6c7ccccc7c7ccccc76)s5)ccc4c4ccccc43)ccc2-c2ccccc21 |
| InChI | InChI=1S/C46H26N3S.C44H25N5S.C38H22N4S.3Pt/c1-2-12-29(13-3-1)45-38-18-5-4-14-32(38)33-25-23-31(27-39(33)45)48-40-19-9-6-17-36(40)37-24-22-30(26-43(37)48)46-47-28-44(50-46)49-41-20-10-7-15-34(41)35-16-8-11-21-42(35)49;1-5-18-37-33(15-1)35-23-22-28(44-46-27-42(50-44)49-39-20-7-2-13-31(39)32-14-3-8-21-40(32)49)25-41(35)47(37)29-11-9-12-30(26-29)48-38-19-6-4-16-34(38)36-17-10-24-45-43(36)48;1-4-16-33-30(14-1)31-20-19-25(32-15-7-8-21-39-32)23-36(31)41(33)27-11-9-10-26(22-27)38-40-24-37(43-38)42-34-17-5-2-12-28(34)29-13-3-6-18-35(29)42;;;/h1-12,14-25,28,45H;1-24,27H;1-21,24H;;;/q-3;2*-2;;2*+2 |
| InChIKey | FNYMEMRSPANAEY-UHFFFAOYSA-N |
| XLogP | 32.32 |
| TPSA | 98.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 146 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2460.51 |
| LogP ≤ 5 | 32.32 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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