C160H144N16O4Pt4 — CID 157180170
2-[3-(5-butyl-3-ethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-ethyl-5-heptyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-ethyl-5-hexyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(5-ethyl-4-phenyl-3-propan-2-ylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) (PubChem CID 157180170) has the molecular formula C160H144N16O4Pt4 and a molecular weight of 3135.33 g/mol. Its IUPAC name is 2-[3-(5-butyl-3-ethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-ethyl-5-heptyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-ethyl-5-hexyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(5-ethyl-4-phenyl-3-propan-2-ylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)).
| Compound Name | 2-[3-(5-butyl-3-ethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-ethyl-5-heptyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-ethyl-5-hexyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(5-ethyl-4-phenyl-3-propan-2-ylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) |
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| PubChem CID | 157180170 |
| Molecular Formula | C160H144N16O4Pt4 |
| Molecular Weight | 3135.33 g/mol |
| Exact Mass | 3133.01 |
| IUPAC Name | 2-[3-(5-butyl-3-ethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-ethyl-5-heptyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(3-ethyl-5-hexyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;2-[3-(5-ethyl-4-phenyl-3-propan-2-ylpyrazol-1-yl)benzene-2-id-1-yl]oxy-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-ide;tetrakis(platinum(2+)) |
| SMILES | CCCCCCCc1c(-c2ccccc2)c(CC)nn1-c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C)ccn2)ccc1.CCCCCCc1c(-c2ccccc2)c(CC)nn1-c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C)ccn2)ccc1.CCCCc1c(-c2ccccc2)c(CC)nn1-c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C)ccn2)ccc1.CCc1c(-c2ccccc2)c(C(C)C)nn1-c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C)ccn2)ccc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2] |
| InChI | InChI=1S/C42H40N4O.C41H38N4O.C39H34N4O.C38H32N4O.4Pt/c1-4-6-7-8-12-22-39-42(31-16-10-9-11-17-31)37(5-2)44-46(39)32-18-15-19-33(28-32)47-34-23-24-36-35-20-13-14-21-38(35)45(40(36)29-34)41-27-30(3)25-26-43-41;1-4-6-7-11-21-38-41(30-15-9-8-10-16-30)36(5-2)43-45(38)31-17-14-18-32(27-31)46-33-22-23-35-34-19-12-13-20-37(34)44(39(35)28-33)40-26-29(3)24-25-42-40;1-4-6-18-36-39(28-13-8-7-9-14-28)34(5-2)41-43(36)29-15-12-16-30(25-29)44-31-20-21-33-32-17-10-11-19-35(32)42(37(33)26-31)38-24-27(3)22-23-40-38;1-5-33-37(27-12-7-6-8-13-27)38(25(2)3)40-42(33)28-14-11-15-29(23-28)43-30-18-19-32-31-16-9-10-17-34(31)41(35(32)24-30)36-22-26(4)20-21-39-36;;;;/h9-11,13-21,23-27H,4-8,12,22H2,1-3H3;8-10,12-20,22-26H,4-7,11,21H2,1-3H3;7-17,19-24H,4-6,18H2,1-3H3;6-22,25H,5H2,1-4H3;;;;/q4*-2;4*+2 |
| InChIKey | ISEXWJJPIXOVGE-UHFFFAOYSA-N |
| XLogP | 40.27 |
| TPSA | 179.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 20 |
| Rotatable Bonds | 39 |
| Heavy Atoms | 184 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3135.33 |
| LogP ≤ 5 | 40.27 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 20 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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