C65H50N2Si — CID 162125262
7-N'-(2-methylphenyl)-7-N',17-N'-diphenyl-17-N'-(2-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine (PubChem CID 162125262) has the molecular formula C65H50N2Si and a molecular weight of 887.21 g/mol. Its IUPAC name is 7-N'-(2-methylphenyl)-7-N',17-N'-diphenyl-17-N'-(2-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine.
| Compound Name | 7-N'-(2-methylphenyl)-7-N',17-N'-diphenyl-17-N'-(2-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine |
|---|---|
| PubChem CID | 162125262 |
| Molecular Formula | C65H50N2Si |
| Molecular Weight | 887.21 g/mol |
| Exact Mass | 886.37 |
| IUPAC Name | 7-N'-(2-methylphenyl)-7-N',17-N'-diphenyl-17-N'-(2-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine |
| SMILES | Cc1ccccc1N(c1ccccc1)c1ccc2c3c(ccc2c1)-c1ccc2cc(N(c4ccccc4)c4ccccc4[Si](C)(C)C)ccc2c1C31c2ccccc2-c2c1ccc1ccccc21 |
| InChI | InChI=1S/C65H50N2Si/c1-43-19-11-16-28-59(43)66(47-21-7-5-8-22-47)49-34-38-52-45(41-49)31-36-54-55-37-32-46-42-50(67(48-23-9-6-10-24-48)60-29-17-18-30-61(60)68(2,3)4)35-39-53(46)64(55)65(63(52)54)57-27-15-14-26-56(57)62-51-25-13-12-20-44(51)33-40-58(62)65/h5-42H,1-4H3 |
| InChIKey | YPFNRAGMBMWUPV-UHFFFAOYSA-N |
| XLogP | 17.28 |
| TPSA | 6.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 68 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 887.21 |
| LogP ≤ 5 | 17.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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