9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole

C171H106N10 — CID 126630474

IUPAC9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole
SMILESc1ccc(C2c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5nc(-c6cccc(-n7c8ccccc8c8cc(-c9ccc%10c%11ccc(-c%12ccc%13c(c%12)c%12ccccc%12n%13-c%12ccccc%12)cc%11n(-c%11ccccc%11)c%10c9)ccc87)c6)nc6ccc(-c7ccc(-n8c9ccccc9c9cc(-c%10ccc%11c%12ccc(-c%13ccc%14c(c%13)c%13ccccc%13n%14-c%13ccccc%13)cc%12n(-c%12ccccc%12)c%11c%10)ccc98)cc7)cc56)c4)cc32)cc1
InChIInChI=1S/C171H106N10/c1-7-33-107(34-8-1)169-149-99-109(111-70-85-159-143(93-111)133-49-19-25-55-153(133)174(159)123-37-9-2-10-38-123)63-78-131(149)132-79-64-110(100-150(132)169)112-71-89-163-147(94-112)137-53-23-29-59-157(137)180(163)129-47-31-35-121(91-129)170-151-101-108(106-61-76-128(77-62-106)177-156-58-28-22-52-136(156)146-97-115(74-88-162(146)177)119-67-82-141-139-80-65-117(102-165(139)178(167(141)104-119)126-43-15-5-16-44-126)113-72-86-160-144(95-113)134-50-20-26-56-154(134)175(160)124-39-11-3-12-40-124)69-84-152(151)172-171(173-170)122-36-32-48-130(92-122)181-158-60-30-24-54-138(158)148-98-116(75-90-164(148)181)120-68-83-142-140-81-66-118(103-166(140)179(168(142)105-120)127-45-17-6-18-46-127)114-73-87-161-145(96-114)135-51-21-27-57-155(135)176(161)125-41-13-4-14-42-125/h1-105,169H
InChIKeyXHZFDDZAUWBMEK-UHFFFAOYSA-N
MW2300.80 g/mol
LogP44.57
Rot. Bonds18

About 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole

9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole (PubChem CID 126630474) has the molecular formula C171H106N10 and a molecular weight of 2300.80 g/mol. Its IUPAC name is 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole.

Molecular Properties

Compound Name9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole
PubChem CID126630474
Molecular FormulaC171H106N10
Molecular Weight2300.80 g/mol
Exact Mass2298.86
IUPAC Name9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole
SMILESc1ccc(C2c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5nc(-c6cccc(-n7c8ccccc8c8cc(-c9ccc%10c%11ccc(-c%12ccc%13c(c%12)c%12ccccc%12n%13-c%12ccccc%12)cc%11n(-c%11ccccc%11)c%10c9)ccc87)c6)nc6ccc(-c7ccc(-n8c9ccccc9c9cc(-c%10ccc%11c%12ccc(-c%13ccc%14c(c%13)c%13ccccc%13n%14-c%13ccccc%13)cc%12n(-c%12ccccc%12)c%11c%10)ccc98)cc7)cc56)c4)cc32)cc1
InChIInChI=1S/C171H106N10/c1-7-33-107(34-8-1)169-149-99-109(111-70-85-159-143(93-111)133-49-19-25-55-153(133)174(159)123-37-9-2-10-38-123)63-78-131(149)132-79-64-110(100-150(132)169)112-71-89-163-147(94-112)137-53-23-29-59-157(137)180(163)129-47-31-35-121(91-129)170-151-101-108(106-61-76-128(77-62-106)177-156-58-28-22-52-136(156)146-97-115(74-88-162(146)177)119-67-82-141-139-80-65-117(102-165(139)178(167(141)104-119)126-43-15-5-16-44-126)113-72-86-160-144(95-113)134-50-20-26-56-154(134)175(160)124-39-11-3-12-40-124)69-84-152(151)172-171(173-170)122-36-32-48-130(92-122)181-158-60-30-24-54-138(158)148-98-116(75-90-164(148)181)120-68-83-142-140-81-66-118(103-166(140)179(168(142)105-120)127-45-17-6-18-46-127)114-73-87-161-145(96-114)135-51-21-27-57-155(135)176(161)125-41-13-4-14-42-125/h1-105,169H
InChIKeyXHZFDDZAUWBMEK-UHFFFAOYSA-N
XLogP44.57
TPSA65.22 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds18
Heavy Atoms181
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002300.80
LogP ≤ 544.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole?
The IUPAC name of 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole (CID 126630474) is 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole.
What is the SMILES notation for 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole?
The canonical SMILES for 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole is c1ccc(C2c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5nc(-c6cccc(-n7c8ccccc8c8cc(-c9ccc%10c%11ccc(-c%12ccc%13c(c%12)c%12ccccc%12n%13-c%12ccccc%12)cc%11n(-c%11ccccc%11)c%10c9)ccc87)c6)nc6ccc(-c7ccc(-n8c9ccccc9c9cc(-c%10ccc%11c%12ccc(-c%13ccc%14c(c%13)c%13ccccc%13n%14-c%13ccccc%13)cc%12n(-c%12ccccc%12)c%11c%10)ccc98)cc7)cc56)c4)cc32)cc1.
What is the InChIKey of 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole?
The InChIKey is XHZFDDZAUWBMEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C171H106N10/c1-7-33-107(34-8-1)169-149-99-109(111-70-85-159-143(93-111)133-49-19-25-55-153(133)174(159)123-37-9-2-10-38-123)63-78-131(149)132-79-64-110(100-150(132)169)112-71-89-163-147(94-112)137-53-23-29-59-157(137)180(163)129-47-31-35-121(91-129)170-151-101-108(106-61-76-128(77-62-106)177-156-58-28-22-52-136(156)146-97-115(74-88-162(146)177)119-67-82-141-139-80-65-117(102-165(139)178(167(141)104-119)126-43-15-5-16-44-126)113-72-86-160-144(95-113)134-50-20-26-56-154(134)175(160)124-39-11-3-12-40-124)69-84-152(151)172-171(173-170)122-36-32-48-130(92-122)181-158-60-30-24-54-138(158)148-98-116(75-90-164(148)181)120-68-83-142-140-81-66-118(103-166(140)179(168(142)105-120)127-45-17-6-18-46-127)114-73-87-161-145(96-114)135-51-21-27-57-155(135)176(161)125-41-13-4-14-42-125/h1-105,169H.
What are the key properties of 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole?
9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole has a molecular weight of 2300.80 g/mol, XLogP of 44.57, 18 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-2-(9-phenylcarbazol-3-yl)-7-[9-[3-[6-[4-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazol-9-yl]phenyl]-4-[3-[3-[9-phenyl-7-(9-phenylcarbazol-3-yl)-9H-fluoren-2-yl]carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazol-3-yl]carbazole is sourced from PubChem (CID 126630474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).