C320H232N8 — CID 158562737
9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-fluoren-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-fluoren-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole;9-[4-[6-(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-fluoren-3-yl]-2,3-dimethylphenyl]carbazole;9-[4-[6-(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-fluoren-3-yl]-2,5-dimethylphenyl]carbazole (PubChem CID 158562737) has the molecular formula C320H232N8 and a molecular weight of 4189.43 g/mol. Its IUPAC name is 9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-fluoren-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-fluoren-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole;9-[4-[6-(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-fluoren-3-yl]-2,3-dimethylphenyl]carbazole;9-[4-[6-(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-fluoren-3-yl]-2,5-dimethylphenyl]carbazole.
| Compound Name | 9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-fluoren-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-fluoren-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole;9-[4-[6-(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-fluoren-3-yl]-2,3-dimethylphenyl]carbazole;9-[4-[6-(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-fluoren-3-yl]-2,5-dimethylphenyl]carbazole |
|---|---|
| PubChem CID | 158562737 |
| Molecular Formula | C320H232N8 |
| Molecular Weight | 4189.43 g/mol |
| Exact Mass | 4185.84 |
| IUPAC Name | 9-[4-[6-[4-[3,6-bis(2-methylpropyl)carbazol-9-yl]phenyl]-9H-fluoren-3-yl]phenyl]-3,6-bis(2-methylpropyl)carbazole;9-[4-[6-[4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazol-9-yl]phenyl]-9H-fluoren-3-yl]phenyl]-3,6-bis(9,9'-spirobi[fluorene]-2-yl)carbazole;9-[4-[6-(4-carbazol-9-yl-2,3-dimethylphenyl)-9H-fluoren-3-yl]-2,3-dimethylphenyl]carbazole;9-[4-[6-(4-carbazol-9-yl-2,5-dimethylphenyl)-9H-fluoren-3-yl]-2,5-dimethylphenyl]carbazole |
| SMILES | CC(C)Cc1ccc2c(c1)c1cc(CC(C)C)ccc1n2-c1ccc(-c2ccc3c(c2)-c2cc(-c4ccc(-n5c6ccc(CC(C)C)cc6c6cc(CC(C)C)ccc65)cc4)ccc2C3)cc1.Cc1c(-c2ccc3c(c2)-c2cc(-c4ccc(-n5c6ccccc6c6ccccc65)c(C)c4C)ccc2C3)ccc(-n2c3ccccc3c3ccccc32)c1C.Cc1cc(-n2c3ccccc3c3ccccc32)c(C)cc1-c1ccc2c(c1)-c1cc(-c3cc(C)c(-n4c5ccccc5c5ccccc54)cc3C)ccc1C2.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)ccc3n4-c3ccc(-c4ccc5c(c4)-c4cc(-c6ccc(-n7c8ccc(-c9ccc%10c(c9)C9(c%11ccccc%11-c%11ccccc%119)c9ccccc9-%10)cc8c8cc(-c9ccc%10c(c9)C9(c%11ccccc%11-c%11ccccc%119)c9ccccc9-%10)ccc87)cc6)ccc4C5)cc3)cc21 |
| InChI | InChI=1S/C149H88N2.C65H64N2.2C53H40N2/c1-13-37-126-104(25-1)105-26-2-14-38-127(105)146(126)134-45-21-9-33-112(134)116-69-57-96(84-138(116)146)92-61-73-142-122(80-92)123-81-93(97-58-70-117-113-34-10-22-46-135(113)147(139(117)85-97)128-39-15-3-27-106(128)107-28-4-16-40-129(107)147)62-74-143(123)150(142)102-65-53-88(54-66-102)90-49-51-100-77-101-52-50-91(79-121(101)120(100)78-90)89-55-67-103(68-56-89)151-144-75-63-94(98-59-71-118-114-35-11-23-47-136(114)148(140(118)86-98)130-41-17-5-29-108(130)109-30-6-18-42-131(109)148)82-124(144)125-83-95(64-76-145(125)151)99-60-72-119-115-36-12-24-48-137(115)149(141(119)87-99)132-43-19-7-31-110(132)111-32-8-20-44-133(111)149;1-40(2)29-44-9-25-62-58(33-44)59-34-45(30-41(3)4)10-26-63(59)66(62)54-21-17-48(18-22-54)50-13-15-52-37-53-16-14-51(39-57(53)56(52)38-50)49-19-23-55(24-20-49)67-64-27-11-46(31-42(5)6)35-60(64)61-36-47(32-43(7)8)12-28-65(61)67;1-32-27-52(54-48-17-9-5-13-40(48)41-14-6-10-18-49(41)54)34(3)25-44(32)38-23-21-36-29-37-22-24-39(31-47(37)46(36)30-38)45-26-35(4)53(28-33(45)2)55-50-19-11-7-15-42(50)43-16-8-12-20-51(43)55;1-32-34(3)48(54-50-17-9-5-13-42(50)43-14-6-10-18-51(43)54)27-25-40(32)38-23-21-36-29-37-22-24-39(31-47(37)46(36)30-38)41-26-28-49(35(4)33(41)2)55-52-19-11-7-15-44(52)45-16-8-12-20-53(45)55/h1-76,78-87H,77H2;9-28,33-36,38-43H,29-32,37H2,1-8H3;2*5-28,30-31H,29H2,1-4H3 |
| InChIKey | HRBWFRUBQNDTIM-UHFFFAOYSA-N |
| XLogP | 82.45 |
| TPSA | 39.44 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 328 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4189.43 |
| LogP ≤ 5 | 82.45 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |