C154H96N6 — CID 134556038
6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole (PubChem CID 134556038) has the molecular formula C154H96N6 and a molecular weight of 2030.50 g/mol. Its IUPAC name is 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole.
| Compound Name | 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole |
|---|---|
| PubChem CID | 134556038 |
| Molecular Formula | C154H96N6 |
| Molecular Weight | 2030.50 g/mol |
| Exact Mass | 2028.77 |
| IUPAC Name | 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole |
| SMILES | c1ccc(-c2ccc(-c3c4ccccc4cc4c5ccccc5n(-c5ccc6c(c5)c5ccccc5n6-c5ccc6ccc(-c7cccc8c7c7cc9ccccc9c(-c9ccc(-c%10ccccc%10)cc9)c7n8-c7ccc8c(c7)c7ccccc7n8-c7ccc(-c8cccc(-c9ccc%10c(c9)c9cc%11ccccc%11c(-c%11ccc(-c%12ccccc%12)cc%11)c9n%10-c9ccc%10c%11ccccc%11n(-c%11ccc(-c%12ccccc%12)cc%11)c%10c9)c8)cc7)cc6c5)c34)cc2)cc1 |
| InChI | InChI=1S/C154H96N6/c1-5-29-97(30-6-1)101-55-62-107(63-56-101)148-124-42-16-13-37-113(124)91-136-131-48-22-26-53-142(131)158(152(136)148)121-81-86-144-135(94-121)130-47-21-25-52-141(130)157(144)120-79-73-106-61-68-116(88-117(106)89-120)127-49-28-54-146-151(127)138-93-115-39-15-18-44-126(115)150(109-66-59-103(60-67-109)99-33-9-3-10-34-99)154(138)160(146)122-82-85-143-134(95-122)129-46-20-24-51-140(129)155(143)118-77-71-105(72-78-118)110-40-27-41-111(87-110)112-74-84-145-133(90-112)137-92-114-38-14-17-43-125(114)149(108-64-57-102(58-65-108)98-31-7-2-8-32-98)153(137)159(145)123-80-83-132-128-45-19-23-50-139(128)156(147(132)96-123)119-75-69-104(70-76-119)100-35-11-4-12-36-100/h1-96H |
| InChIKey | HKFXOCQLNRKVBO-UHFFFAOYSA-N |
| XLogP | 41.55 |
| TPSA | 29.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 160 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2030.50 |
| LogP ≤ 5 | 41.55 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |