C147H92N4 — CID 154554195
3-(4-carbazol-9-ylphenyl)-6-[6-[9-[4-[6-naphthalen-2-yl-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazol-4-yl]-9,9-diphenylfluoren-2-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole (PubChem CID 154554195) has the molecular formula C147H92N4 and a molecular weight of 1914.38 g/mol. Its IUPAC name is 3-(4-carbazol-9-ylphenyl)-6-[6-[9-[4-[6-naphthalen-2-yl-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazol-4-yl]-9,9-diphenylfluoren-2-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole.
| Compound Name | 3-(4-carbazol-9-ylphenyl)-6-[6-[9-[4-[6-naphthalen-2-yl-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazol-4-yl]-9,9-diphenylfluoren-2-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole |
|---|---|
| PubChem CID | 154554195 |
| Molecular Formula | C147H92N4 |
| Molecular Weight | 1914.38 g/mol |
| Exact Mass | 1912.73 |
| IUPAC Name | 3-(4-carbazol-9-ylphenyl)-6-[6-[9-[4-[6-naphthalen-2-yl-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]carbazol-4-yl]-9,9-diphenylfluoren-2-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole |
| SMILES | c1ccc(-c2c3ccccc3c(-c3ccc(-n4c5ccc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)cc5c5cc(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccc(-c8cccc9c8c8ccccc8n9-c8ccc(-c9ccc%10c(c9)c9cc(-c%11ccc%12ccccc%12c%11)ccc9n%10-c9ccc(-c%10c%11ccccc%11c(-c%11ccccc%11)c%11ccccc%10%11)cc9)cc8)cc6-7)ccc54)cc3)c3ccccc23)cc1 |
| InChI | InChI=1S/C147H92N4/c1-5-31-96(32-6-1)142-118-42-15-19-46-122(118)144(123-47-20-16-43-119(123)142)98-62-76-111(77-63-98)149-137-82-69-103(87-128(137)130-89-104(70-84-139(130)149)101-57-56-93-30-13-14-35-100(93)86-101)95-60-74-113(75-61-95)151-136-54-28-25-50-126(136)146-114(51-29-55-141(146)151)107-67-81-132-127(91-107)115-80-66-106(92-133(115)147(132,108-36-9-3-10-37-108)109-38-11-4-12-39-109)105-71-85-140-131(90-105)129-88-102(94-58-72-110(73-59-94)148-134-52-26-23-40-116(134)117-41-24-27-53-135(117)148)68-83-138(129)150(140)112-78-64-99(65-79-112)145-124-48-21-17-44-120(124)143(97-33-7-2-8-34-97)121-45-18-22-49-125(121)145/h1-92H |
| InChIKey | CUUQNUCVNLRUKG-UHFFFAOYSA-N |
| XLogP | 39.21 |
| TPSA | 19.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 151 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1914.38 |
| LogP ≤ 5 | 39.21 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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