C153H102Ge3N10O — CID 160720044
4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidine;5-[4-(2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidin-4-yl)phenyl]-[1]benzofuro[3,2-c]carbazole;2,5,5-triphenyl-4-(12-phenylindolo[3,2-c]carbazol-5-yl)-[1]benzogermolo[3,2-d]pyrimidine (PubChem CID 160720044) has the molecular formula C153H102Ge3N10O and a molecular weight of 2314.40 g/mol. Its IUPAC name is 4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidine;5-[4-(2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidin-4-yl)phenyl]-[1]benzofuro[3,2-c]carbazole;2,5,5-triphenyl-4-(12-phenylindolo[3,2-c]carbazol-5-yl)-[1]benzogermolo[3,2-d]pyrimidine.
| Compound Name | 4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidine;5-[4-(2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidin-4-yl)phenyl]-[1]benzofuro[3,2-c]carbazole;2,5,5-triphenyl-4-(12-phenylindolo[3,2-c]carbazol-5-yl)-[1]benzogermolo[3,2-d]pyrimidine |
|---|---|
| PubChem CID | 160720044 |
| Molecular Formula | C153H102Ge3N10O |
| Molecular Weight | 2314.40 g/mol |
| Exact Mass | 2316.59 |
| IUPAC Name | 4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidine;5-[4-(2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidin-4-yl)phenyl]-[1]benzofuro[3,2-c]carbazole;2,5,5-triphenyl-4-(12-phenylindolo[3,2-c]carbazol-5-yl)-[1]benzogermolo[3,2-d]pyrimidine |
| SMILES | CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1nc(-c2ccccc2)nc2c1[Ge](c1ccccc1)(c1ccccc1)c1ccccc1-2.c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)cc3)c3c(n2)-c2ccccc2[Ge]3(c2ccccc2)c2ccccc2)cc1.c1ccc(-c2nc3c(c(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccccc6)c45)n2)[Ge](c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1 |
| InChI | InChI=1S/C52H34GeN4.C52H33GeN3O.C49H35GeN3/c1-5-19-35(20-6-1)51-54-49-41-28-13-16-30-43(41)53(36-21-7-2-8-22-36,37-23-9-3-10-24-37)48(49)52(55-51)57-45-32-18-15-29-42(45)47-46(57)34-33-40-39-27-14-17-31-44(39)56(50(40)47)38-25-11-4-12-26-38;1-4-16-35(17-5-1)52-54-49(48-50(55-52)41-23-10-13-25-43(41)53(48,36-18-6-2-7-19-36)37-20-8-3-9-21-37)34-28-30-38(31-29-34)56-44-26-14-11-24-42(44)47-45(56)33-32-40-39-22-12-15-27-46(39)57-51(40)47;1-49(2)39-27-15-12-24-35(39)36-30-31-42-43(44(36)49)38-26-14-17-29-41(38)53(42)48-45-46(51-47(52-48)32-18-6-3-7-19-32)37-25-13-16-28-40(37)50(45,33-20-8-4-9-21-33)34-22-10-5-11-23-34/h1-34H;1-33H;3-31H,1-2H3 |
| InChIKey | RSZFMAFPMIHRNI-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 |