4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine

C180H126N4 — CID 155334807

About 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine

4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine (PubChem CID 155334807) has the molecular formula C180H126N4 and a molecular weight of 2345.02 g/mol. Its IUPAC name is 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine.

Molecular Properties

• Compound Name: 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine
• PubChem CID: 155334807
• Molecular Formula: C180H126N4
• Molecular Weight: 2345.02 g/mol
• Exact Mass: 2343.00
• IUPAC Name: 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine
• SMILES: CN1c2ccccc2C(C)(C)c2cccc(-c3cccc4c(-c5c6cccc(-c7cccc8ccccc78)c6cc6c(-c7ccc(-c8ccc(C9(c%10ccccc%10)c%10ccccc%10N(C)c%10c(-c%11cccc%12c(-c%13c%14cccc(-c%15cccc%16ccccc%15%16)c%14cc%14c(-c%15cccc%16ccccc%15%16)cccc%13%14)c%13cccc(-c%14cccc%15c%14N(C)c%14ccccc%14C%15(c%14ccccc%14)c%14ccccc%14)c%13cc%11%12)cccc%109)cc8)c8ccccc78)cccc56)c5cccc(-c6cccc7c6N(C)c6ccccc6C7(C)C)c5cc34)c21
• InChI: InChI=1S/C180H126N4/c1-177(2)157-89-26-30-97-165(157)181(5)173-145(85-45-93-161(173)177)132-73-41-81-141-153(132)109-154-133(146-86-46-94-162-174(146)182(6)166-98-31-27-90-158(166)178(162,3)4)74-42-82-142(154)171(141)170-139-79-39-71-130(126-68-36-54-113-51-20-23-63-121(113)126)151(139)108-152-131(72-40-80-140(152)170)136-106-105-122(123-64-24-25-65-127(123)136)114-101-103-118(104-102-114)180(117-59-16-11-17-60-117)160-92-29-33-100-168(160)184(8)176-148(88-48-96-164(176)180)135-76-44-84-144-156(135)110-155-134(147-87-47-95-163-175(147)183(7)167-99-32-28-91-159(167)179(163,115-55-12-9-13-56-115)116-57-14-10-15-58-116)75-43-83-143(155)172(144)169-137-77-37-69-128(124-66-34-52-111-49-18-21-61-119(111)124)149(137)107-150-129(70-38-78-138(150)169)125-67-35-53-112-50-19-22-62-120(112)125/h9-110H,1-8H3
• InChIKey: WTXDMNUPYBRKOM-UHFFFAOYSA-N
• XLogP: 47.60
• TPSA: 12.96 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 15
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2345.02
LogP ≤ 5	47.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine?

The IUPAC name of 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine (CID 155334807) is 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine.

What is the SMILES notation for 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine?

The canonical SMILES for 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine is CN1c2ccccc2C(C)(C)c2cccc(-c3cccc4c(-c5c6cccc(-c7cccc8ccccc78)c6cc6c(-c7ccc(-c8ccc(C9(c%10ccccc%10)c%10ccccc%10N(C)c%10c(-c%11cccc%12c(-c%13c%14cccc(-c%15cccc%16ccccc%15%16)c%14cc%14c(-c%15cccc%16ccccc%15%16)cccc%13%14)c%13cccc(-c%14cccc%15c%14N(C)c%14ccccc%14C%15(c%14ccccc%14)c%14ccccc%14)c%13cc%11%12)cccc%109)cc8)c8ccccc78)cccc56)c5cccc(-c6cccc7c6N(C)c6ccccc6C7(C)C)c5cc34)c21.

What is the InChIKey of 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine?

The InChIKey is WTXDMNUPYBRKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C180H126N4/c1-177(2)157-89-26-30-97-165(157)181(5)173-145(85-45-93-161(173)177)132-73-41-81-141-153(132)109-154-133(146-86-46-94-162-174(146)182(6)166-98-31-27-90-158(166)178(162,3)4)74-42-82-142(154)171(141)170-139-79-39-71-130(126-68-36-54-113-51-20-23-63-121(113)126)151(139)108-152-131(72-40-80-140(152)170)136-106-105-122(123-64-24-25-65-127(123)136)114-101-103-118(104-102-114)180(117-59-16-11-17-60-117)160-92-29-33-100-168(160)184(8)176-148(88-48-96-164(176)180)135-76-44-84-144-156(135)110-155-134(147-87-47-95-163-175(147)183(7)167-99-32-28-91-159(167)179(163,115-55-12-9-13-56-115)116-57-14-10-15-58-116)75-43-83-143(155)172(144)169-137-77-37-69-128(124-66-34-52-111-49-18-21-61-119(111)124)149(137)107-150-129(70-38-78-138(150)169)125-67-35-53-112-50-19-22-62-120(112)125/h9-110H,1-8H3.

What are the key properties of 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine?

4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine has a molecular weight of 2345.02 g/mol, XLogP of 47.60, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[8-[9-[4-[4-[10-[4,5-bis(9,9,10-trimethylacridin-4-yl)anthracen-9-yl]-8-naphthalen-1-ylanthracen-1-yl]naphthalen-1-yl]phenyl]-10-methyl-9-phenylacridin-4-yl]-10-(4,5-dinaphthalen-1-ylanthracen-9-yl)anthracen-1-yl]-10-methyl-9,9-diphenylacridine is sourced from PubChem (CID 155334807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).