1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole

C167H104N10 — CID 126630632

IUPAC1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole
SMILESc1ccc(C2c3ccccc3-c3ccc(-c4cccc5c6cccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)c6n(-c6cccc(-c7nc(-c8cccc(-n9c%10c(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccccc%11)cccc%10c%10cccc(-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)c%109)c8)cc(-c8cccc(-n9c%10c(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccccc%11)cccc%10c%10cccc(-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)c%109)c8)n7)c6)c45)cc32)cc1
InChIInChI=1S/C167H104N10/c1-7-40-104(41-8-1)160-137-64-20-19-58-128(137)129-88-82-105(100-147(129)160)122-65-34-71-138-139-72-37-68-125(108-87-93-157-146(99-108)134-63-25-30-81-154(134)172(157)116-49-13-4-14-50-116)164(139)177(161(122)138)121-57-33-44-113(96-121)167-168-148(111-42-31-55-119(94-111)175-162-123(106-85-91-155-144(97-106)132-61-23-28-79-152(132)170(155)114-45-9-2-10-46-114)66-35-73-140(162)142-75-38-69-126(165(142)175)109-83-89-135-130-59-21-26-77-150(130)173(158(135)101-109)117-51-15-5-16-52-117)103-149(169-167)112-43-32-56-120(95-112)176-163-124(107-86-92-156-145(98-107)133-62-24-29-80-153(133)171(156)115-47-11-3-12-48-115)67-36-74-141(163)143-76-39-70-127(166(143)176)110-84-90-136-131-60-22-27-78-151(131)174(159(136)102-110)118-53-17-6-18-54-118/h1-103,160H
InChIKeyAKKHCXABDYNJKL-UHFFFAOYSA-N
MW2250.74 g/mol
LogP43.42
Rot. Bonds18

About 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole

1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole (PubChem CID 126630632) has the molecular formula C167H104N10 and a molecular weight of 2250.74 g/mol. Its IUPAC name is 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole.

Molecular Properties

Compound Name1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole
PubChem CID126630632
Molecular FormulaC167H104N10
Molecular Weight2250.74 g/mol
Exact Mass2248.84
IUPAC Name1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole
SMILESc1ccc(C2c3ccccc3-c3ccc(-c4cccc5c6cccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)c6n(-c6cccc(-c7nc(-c8cccc(-n9c%10c(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccccc%11)cccc%10c%10cccc(-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)c%109)c8)cc(-c8cccc(-n9c%10c(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccccc%11)cccc%10c%10cccc(-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)c%109)c8)n7)c6)c45)cc32)cc1
InChIInChI=1S/C167H104N10/c1-7-40-104(41-8-1)160-137-64-20-19-58-128(137)129-88-82-105(100-147(129)160)122-65-34-71-138-139-72-37-68-125(108-87-93-157-146(99-108)134-63-25-30-81-154(134)172(157)116-49-13-4-14-50-116)164(139)177(161(122)138)121-57-33-44-113(96-121)167-168-148(111-42-31-55-119(94-111)175-162-123(106-85-91-155-144(97-106)132-61-23-28-79-152(132)170(155)114-45-9-2-10-46-114)66-35-73-140(162)142-75-38-69-126(165(142)175)109-83-89-135-130-59-21-26-77-150(130)173(158(135)101-109)117-51-15-5-16-52-117)103-149(169-167)112-43-32-56-120(95-112)176-163-124(107-86-92-156-145(98-107)133-62-24-29-80-153(133)171(156)115-47-11-3-12-48-115)67-36-74-141(163)143-76-39-70-127(166(143)176)110-84-90-136-131-60-22-27-78-151(131)174(159(136)102-110)118-53-17-6-18-54-118/h1-103,160H
InChIKeyAKKHCXABDYNJKL-UHFFFAOYSA-N
XLogP43.42
TPSA65.22 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds18
Heavy Atoms177
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002250.74
LogP ≤ 543.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole?
The IUPAC name of 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole (CID 126630632) is 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole.
What is the SMILES notation for 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole?
The canonical SMILES for 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole is c1ccc(C2c3ccccc3-c3ccc(-c4cccc5c6cccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)c6n(-c6cccc(-c7nc(-c8cccc(-n9c%10c(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccccc%11)cccc%10c%10cccc(-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)c%109)c8)cc(-c8cccc(-n9c%10c(-c%11ccc%12c(c%11)c%11ccccc%11n%12-c%11ccccc%11)cccc%10c%10cccc(-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)c%109)c8)n7)c6)c45)cc32)cc1.
What is the InChIKey of 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole?
The InChIKey is AKKHCXABDYNJKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C167H104N10/c1-7-40-104(41-8-1)160-137-64-20-19-58-128(137)129-88-82-105(100-147(129)160)122-65-34-71-138-139-72-37-68-125(108-87-93-157-146(99-108)134-63-25-30-81-154(134)172(157)116-49-13-4-14-50-116)164(139)177(161(122)138)121-57-33-44-113(96-121)167-168-148(111-42-31-55-119(94-111)175-162-123(106-85-91-155-144(97-106)132-61-23-28-79-152(132)170(155)114-45-9-2-10-46-114)66-35-73-140(162)142-75-38-69-126(165(142)175)109-83-89-135-130-59-21-26-77-150(130)173(158(135)101-109)117-51-15-5-16-52-117)103-149(169-167)112-43-32-56-120(95-112)176-163-124(107-86-92-156-145(98-107)133-62-24-29-80-153(133)171(156)115-47-11-3-12-48-115)67-36-74-141(163)143-76-39-70-127(166(143)176)110-84-90-136-131-60-22-27-78-151(131)174(159(136)102-110)118-53-17-6-18-54-118/h1-103,160H.
What are the key properties of 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole?
1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole has a molecular weight of 2250.74 g/mol, XLogP of 43.42, 18 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)-9-[3-[6-[3-[1-(9-phenylcarbazol-2-yl)-8-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-2-[3-[1-(9-phenylcarbazol-3-yl)-8-(9-phenyl-9H-fluoren-2-yl)carbazol-9-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole is sourced from PubChem (CID 126630632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).