C50H30N4O2PtSi — CID 162483200
21-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-14,14-diphenyl-9-oxa-19,21-diaza-14-silapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene;platinum(2+) (PubChem CID 162483200) has the molecular formula C50H30N4O2PtSi and a molecular weight of 941.98 g/mol. Its IUPAC name is 21-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-14,14-diphenyl-9-oxa-19,21-diaza-14-silapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene;platinum(2+).
| Compound Name | 21-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-14,14-diphenyl-9-oxa-19,21-diaza-14-silapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene;platinum(2+) |
|---|---|
| PubChem CID | 162483200 |
| Molecular Formula | C50H30N4O2PtSi |
| Molecular Weight | 941.98 g/mol |
| Exact Mass | 941.18 |
| IUPAC Name | 21-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-14,14-diphenyl-9-oxa-19,21-diaza-14-silapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene;platinum(2+) |
| SMILES | [Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n2ccnc32)cccc1N1c2ncccc2[Si](c2ccccc2)(c2ccccc2)c2ccc3oc4ccccc4c3c21 |
| InChI | InChI=1S/C50H30N4O2Si.Pt/c1-3-15-36(16-4-1)57(37-17-5-2-6-18-37)45-27-26-44-47(40-20-8-10-22-43(40)56-44)48(45)54(50-46(57)23-12-28-51-50)33-13-11-14-34(31-33)55-35-24-25-38-39-19-7-9-21-42(39)53-30-29-52-49(53)41(38)32-35;/h1-30H;/q-2;+2 |
| InChIKey | VUUNIFDRAAPUJD-UHFFFAOYSA-N |
| XLogP | 9.49 |
| TPSA | 55.80 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 58 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 941.98 |
| LogP ≤ 5 | 9.49 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'} |
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