C148H102N21O5Pt5+ — CID 157456546
6-(3H-1-benzofuran-3-id-4-yl)-N-[6-(7H-indol-7-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-(5,6-dihydro-1H-carbazol-1-id-9-yl)-10-[6-(8H-naphthalen-8-id-1-yl)-2-pyridinyl]-5a,9a-dihydropyrido[3,2-b][1,4]benzoxazine;6-(1,6-dimethyl-3H-pyrrolo[2,3-b]pyrrol-1-ium-3-id-4-yl)-N-[[(5-ethenoxyfuran-3-yl)methylideneamino]methyl]-N-phenylpyridin-2-amine;2-(1-methyl-2H-indol-2-id-3-yl)-4-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]pyrrolo[2,3-d][1,3]oxazole;2-phenyl-9-(6-phenyl-2-pyridinyl)pyrido[2,3-b]indole;pentakis(platinum(2+)) (PubChem CID 157456546) has the molecular formula C148H102N21O5Pt5+ and a molecular weight of 3229.98 g/mol. Its IUPAC name is 6-(3H-1-benzofuran-3-id-4-yl)-N-[6-(7H-indol-7-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-(5,6-dihydro-1H-carbazol-1-id-9-yl)-10-[6-(8H-naphthalen-8-id-1-yl)-2-pyridinyl]-5a,9a-dihydropyrido[3,2-b][1,4]benzoxazine;6-(1,6-dimethyl-3H-pyrrolo[2,3-b]pyrrol-1-ium-3-id-4-yl)-N-[[(5-ethenoxyfuran-3-yl)methylideneamino]methyl]-N-phenylpyridin-2-amine;2-(1-methyl-2H-indol-2-id-3-yl)-4-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]pyrrolo[2,3-d][1,3]oxazole;2-phenyl-9-(6-phenyl-2-pyridinyl)pyrido[2,3-b]indole;pentakis(platinum(2+)).
| Compound Name | 6-(3H-1-benzofuran-3-id-4-yl)-N-[6-(7H-indol-7-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-(5,6-dihydro-1H-carbazol-1-id-9-yl)-10-[6-(8H-naphthalen-8-id-1-yl)-2-pyridinyl]-5a,9a-dihydropyrido[3,2-b][1,4]benzoxazine;6-(1,6-dimethyl-3H-pyrrolo[2,3-b]pyrrol-1-ium-3-id-4-yl)-N-[[(5-ethenoxyfuran-3-yl)methylideneamino]methyl]-N-phenylpyridin-2-amine;2-(1-methyl-2H-indol-2-id-3-yl)-4-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]pyrrolo[2,3-d][1,3]oxazole;2-phenyl-9-(6-phenyl-2-pyridinyl)pyrido[2,3-b]indole;pentakis(platinum(2+)) |
|---|---|
| PubChem CID | 157456546 |
| Molecular Formula | C148H102N21O5Pt5+ |
| Molecular Weight | 3229.98 g/mol |
| Exact Mass | 3227.66 |
| IUPAC Name | 6-(3H-1-benzofuran-3-id-4-yl)-N-[6-(7H-indol-7-id-1-yl)-2-pyridinyl]-N-phenylpyridin-2-amine;2-(5,6-dihydro-1H-carbazol-1-id-9-yl)-10-[6-(8H-naphthalen-8-id-1-yl)-2-pyridinyl]-5a,9a-dihydropyrido[3,2-b][1,4]benzoxazine;6-(1,6-dimethyl-3H-pyrrolo[2,3-b]pyrrol-1-ium-3-id-4-yl)-N-[[(5-ethenoxyfuran-3-yl)methylideneamino]methyl]-N-phenylpyridin-2-amine;2-(1-methyl-2H-indol-2-id-3-yl)-4-[6-(2H-pyrrol-2-id-1-yl)-2-pyridinyl]pyrrolo[2,3-d][1,3]oxazole;2-phenyl-9-(6-phenyl-2-pyridinyl)pyrido[2,3-b]indole;pentakis(platinum(2+)) |
| SMILES | Cn1[c-]c(-c2nc3c(ccn3-c3cccc(-n4[c-]ccc4)n3)o2)c2ccccc21.[H]/[C-]=C/Oc1cc(C=NCN(c2ccccc2)c2cccc(-c3cn(C)c4c3[cH-]c[n+]4C)n2)co1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1cccc2cccc(-c3cccc(N4c5nc(-n6c7c(c8ccc[c-]c86)CCC=C7)ccc5OC5C=CC=CC54)n3)c12.[c-]1ccccc1-c1cccc(-n2c3ccccc3c3ccc(-c4[c-]cccc4)nc32)n1.[c-]1coc2cccc(-c3cccc(N(c4ccccc4)c4cccc(-n5ccc6ccc[c-]c65)n4)n3)c12 |
| InChI | InChI=1S/C38H26N4O.C32H20N4O.C28H17N3.C27H24N5O2.C23H15N5O.5Pt/c1-2-13-26-25(11-1)12-9-16-27(26)30-17-10-22-36(39-30)42-33-20-7-8-21-34(33)43-35-23-24-37(40-38(35)42)41-31-18-5-3-14-28(31)29-15-4-6-19-32(29)41;1-2-10-24(11-3-1)36(31-17-7-13-27(33-31)25-12-6-15-29-26(25)20-22-37-29)32-18-8-16-30(34-32)35-21-19-23-9-4-5-14-28(23)35;1-3-10-20(11-4-1)24-15-9-17-27(29-24)31-26-16-8-7-14-22(26)23-18-19-25(30-28(23)31)21-12-5-2-6-13-21;1-4-33-26-15-20(18-34-26)16-28-19-32(21-9-6-5-7-10-21)25-12-8-11-24(29-25)23-17-31(3)27-22(23)13-14-30(27)2;1-26-15-17(16-7-2-3-8-18(16)26)23-25-22-19(29-23)11-14-28(22)21-10-6-9-20(24-21)27-12-4-5-13-27;;;;;/h1-3,5-12,14,16-17,19-24,33-34H,4,15H2;1-13,15-19,21-22H;1-10,12,14-19H;1,4-18H,19H2,2-3H3;2-12,14H,1H3;;;;;/q3*-2;-1;-2;5*+2 |
| InChIKey | UMZWSWSUEGRLLX-UHFFFAOYSA-N |
| XLogP | 32.07 |
| TPSA | 234.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 25 |
| Rotatable Bonds | 22 |
| Heavy Atoms | 179 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3229.98 |
| LogP ≤ 5 | 32.07 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 25 |
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'} |
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