2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole

C174H105N9O2 — CID 163533750

IUPAC2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5ccc6c(c5)oc5ccc(-n7c8ccccc8c8ccc(-c9ccccc9)c(-c9ccc%10c%11ccccc%11n(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccc(-c%12ccc%13oc%14c(-n%15c%16ccccc%16c%16ccc(-c%17ccccc%17)c(-c%17ccc%18c%19ccccc%19n(-c%19ccc%20c(c%19)c%19ccccc%19n%20-c%19ccccc%19)c%18c%17)c%16%15)cccc%14c%13c%12)cc%11)c%10c9)c87)cc56)c4)c3c2)cc1
InChIInChI=1S/C174H105N9O2/c1-6-36-107(37-7-1)124-85-88-140-130-51-19-31-64-155(130)181(117-45-14-5-15-46-117)171(140)168(124)113-71-81-136-127-48-17-27-60-151(127)180(162(136)98-113)122-79-93-160-146(104-122)135-56-24-30-63-154(135)177(160)119-47-34-42-110(96-119)112-70-84-139-148-105-123(80-95-165(148)184-167(139)101-112)182-156-65-32-20-52-131(156)141-89-86-125(108-38-8-2-9-39-108)169(172(141)182)114-72-82-137-128-49-16-25-58-149(128)178(163(137)99-114)121-78-92-159-145(103-121)134-55-23-29-62-153(134)176(159)118-75-68-106(69-76-118)111-74-94-166-147(97-111)143-57-35-67-161(174(143)185-166)183-157-66-33-21-53-132(157)142-90-87-126(109-40-10-3-11-41-109)170(173(142)183)115-73-83-138-129-50-18-26-59-150(129)179(164(138)100-115)120-77-91-158-144(102-120)133-54-22-28-61-152(133)175(158)116-43-12-4-13-44-116/h1-105H
InChIKeyDVEIWGFDWNYVOL-UHFFFAOYSA-N
MW2353.81 g/mol
LogP46.70
Rot. Bonds17

About 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole

2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole (PubChem CID 163533750) has the molecular formula C174H105N9O2 and a molecular weight of 2353.81 g/mol. Its IUPAC name is 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole.

Molecular Properties

Compound Name2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole
PubChem CID163533750
Molecular FormulaC174H105N9O2
Molecular Weight2353.81 g/mol
Exact Mass2351.84
IUPAC Name2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5ccc6c(c5)oc5ccc(-n7c8ccccc8c8ccc(-c9ccccc9)c(-c9ccc%10c%11ccccc%11n(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccc(-c%12ccc%13oc%14c(-n%15c%16ccccc%16c%16ccc(-c%17ccccc%17)c(-c%17ccc%18c%19ccccc%19n(-c%19ccc%20c(c%19)c%19ccccc%19n%20-c%19ccccc%19)c%18c%17)c%16%15)cccc%14c%13c%12)cc%11)c%10c9)c87)cc56)c4)c3c2)cc1
InChIInChI=1S/C174H105N9O2/c1-6-36-107(37-7-1)124-85-88-140-130-51-19-31-64-155(130)181(117-45-14-5-15-46-117)171(140)168(124)113-71-81-136-127-48-17-27-60-151(127)180(162(136)98-113)122-79-93-160-146(104-122)135-56-24-30-63-154(135)177(160)119-47-34-42-110(96-119)112-70-84-139-148-105-123(80-95-165(148)184-167(139)101-112)182-156-65-32-20-52-131(156)141-89-86-125(108-38-8-2-9-39-108)169(172(141)182)114-72-82-137-128-49-16-25-58-149(128)178(163(137)99-114)121-78-92-159-145(103-121)134-55-23-29-62-153(134)176(159)118-75-68-106(69-76-118)111-74-94-166-147(97-111)143-57-35-67-161(174(143)185-166)183-157-66-33-21-53-132(157)142-90-87-126(109-40-10-3-11-41-109)170(173(142)183)115-73-83-138-129-50-18-26-59-150(129)179(164(138)100-115)120-77-91-158-144(102-120)133-54-22-28-61-152(133)175(158)116-43-12-4-13-44-116/h1-105H
InChIKeyDVEIWGFDWNYVOL-UHFFFAOYSA-N
XLogP46.70
TPSA70.65 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds17
Heavy Atoms185
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002353.81
LogP ≤ 546.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole?
The IUPAC name of 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole (CID 163533750) is 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole.
What is the SMILES notation for 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole?
The canonical SMILES for 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole is c1ccc(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5ccc6c(c5)oc5ccc(-n7c8ccccc8c8ccc(-c9ccccc9)c(-c9ccc%10c%11ccccc%11n(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccc(-c%12ccc%13oc%14c(-n%15c%16ccccc%16c%16ccc(-c%17ccccc%17)c(-c%17ccc%18c%19ccccc%19n(-c%19ccc%20c(c%19)c%19ccccc%19n%20-c%19ccccc%19)c%18c%17)c%16%15)cccc%14c%13c%12)cc%11)c%10c9)c87)cc56)c4)c3c2)cc1.
What is the InChIKey of 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole?
The InChIKey is DVEIWGFDWNYVOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C174H105N9O2/c1-6-36-107(37-7-1)124-85-88-140-130-51-19-31-64-155(130)181(117-45-14-5-15-46-117)171(140)168(124)113-71-81-136-127-48-17-27-60-151(127)180(162(136)98-113)122-79-93-160-146(104-122)135-56-24-30-63-154(135)177(160)119-47-34-42-110(96-119)112-70-84-139-148-105-123(80-95-165(148)184-167(139)101-112)182-156-65-32-20-52-131(156)141-89-86-125(108-38-8-2-9-39-108)169(172(141)182)114-72-82-137-128-49-16-25-58-149(128)178(163(137)99-114)121-78-92-159-145(103-121)134-55-23-29-62-153(134)176(159)118-75-68-106(69-76-118)111-74-94-166-147(97-111)143-57-35-67-161(174(143)185-166)183-157-66-33-21-53-132(157)142-90-87-126(109-40-10-3-11-41-109)170(173(142)183)115-73-83-138-129-50-18-26-59-150(129)179(164(138)100-115)120-77-91-158-144(102-120)133-54-22-28-61-152(133)175(158)116-43-12-4-13-44-116/h1-105H.
What are the key properties of 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole?
2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole has a molecular weight of 2353.81 g/mol, XLogP of 46.70, 17 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-diphenyl-1-[9-[9-[3-[8-[2-phenyl-1-[9-[9-[4-[6-[2-phenyl-1-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]dibenzofuran-2-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazol-9-yl]dibenzofuran-3-yl]phenyl]carbazol-3-yl]carbazol-2-yl]carbazole is sourced from PubChem (CID 163533750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).