C153H102Ge3N10O — CID 159735009
2-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-4,9,9-triphenyl-[1]benzogermolo[2,3-d]pyrimidine;12-[4-(4,9,9-triphenyl-[1]benzogermolo[2,3-d]pyrimidin-2-yl)phenyl]-[1]benzofuro[2,3-a]carbazole;4,9,9-triphenyl-2-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzogermolo[2,3-d]pyrimidine (PubChem CID 159735009) has the molecular formula C153H102Ge3N10O and a molecular weight of 2314.40 g/mol. Its IUPAC name is 2-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-4,9,9-triphenyl-[1]benzogermolo[2,3-d]pyrimidine;12-[4-(4,9,9-triphenyl-[1]benzogermolo[2,3-d]pyrimidin-2-yl)phenyl]-[1]benzofuro[2,3-a]carbazole;4,9,9-triphenyl-2-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzogermolo[2,3-d]pyrimidine.
| Compound Name | 2-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-4,9,9-triphenyl-[1]benzogermolo[2,3-d]pyrimidine;12-[4-(4,9,9-triphenyl-[1]benzogermolo[2,3-d]pyrimidin-2-yl)phenyl]-[1]benzofuro[2,3-a]carbazole;4,9,9-triphenyl-2-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzogermolo[2,3-d]pyrimidine |
|---|---|
| PubChem CID | 159735009 |
| Molecular Formula | C153H102Ge3N10O |
| Molecular Weight | 2314.40 g/mol |
| Exact Mass | 2316.59 |
| IUPAC Name | 2-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-4,9,9-triphenyl-[1]benzogermolo[2,3-d]pyrimidine;12-[4-(4,9,9-triphenyl-[1]benzogermolo[2,3-d]pyrimidin-2-yl)phenyl]-[1]benzofuro[2,3-a]carbazole;4,9,9-triphenyl-2-(11-phenylindolo[2,3-a]carbazol-12-yl)-[1]benzogermolo[2,3-d]pyrimidine |
| SMILES | CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4nc(-c5ccccc5)c5c(n4)[Ge](c4ccccc4)(c4ccccc4)c4ccccc4-5)c3c21.c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccc6c7ccccc7oc6c54)cc3)nc3c2-c2ccccc2[Ge]3(c2ccccc2)c2ccccc2)cc1.c1ccc(-c2nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)nc3c2-c2ccccc2[Ge]3(c2ccccc2)c2ccccc2)cc1 |
| InChI | InChI=1S/C52H34GeN4.C52H33GeN3O.C49H35GeN3/c1-5-19-35(20-6-1)48-47-43-29-13-16-30-44(43)53(36-21-7-2-8-22-36,37-23-9-3-10-24-37)51(47)55-52(54-48)57-46-32-18-15-28-40(46)42-34-33-41-39-27-14-17-31-45(39)56(49(41)50(42)57)38-25-11-4-12-26-38;1-4-16-34(17-5-1)48-47-43-24-10-13-25-44(43)53(36-18-6-2-7-19-36,37-20-8-3-9-21-37)51(47)55-52(54-48)35-28-30-38(31-29-35)56-45-26-14-11-22-39(45)41-32-33-42-40-23-12-15-27-46(40)57-50(42)49(41)56;1-49(2)40-27-15-12-24-35(40)37-30-31-38-36-25-14-17-29-42(36)53(46(38)44(37)49)48-51-45(32-18-6-3-7-19-32)43-39-26-13-16-28-41(39)50(47(43)52-48,33-20-8-4-9-21-33)34-22-10-5-11-23-34/h1-34H;1-33H;3-31H,1-2H3 |
| InChIKey | NBSKTJBQUDIRPJ-UHFFFAOYSA-N |
| XLogP | 28.77 |
| TPSA | 110.20 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 11 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 167 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2314.40 |
| LogP ≤ 5 | 28.77 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 11 |