N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine

C170H125N7OS — CID 156568070

IUPACN-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine
SMILESc1ccc(-n2c3ccccc3c3ccc(N(c4ccc(-n5c6ccccc6c6cc(-c7cccc8c7c7ccccc7n8-c7ccc(N(c8ccc(-n9c%10ccccc%10c%10cc(-c%11cccc%12oc%13c(-c%14ccc(N(c%15ccc%16c(c%15)-c%15ccccc%15C%16%15C%16CC%17CC%18CC%15C%18(C%17)C%16)c%15ccc%16c(c%15)sc%15ccccc%15%16)cc%14)cccc%13c%11%12)ccc%109)cc8)c8ccc9c(c8)-c8ccccc8C98C9CC%10CC(C9)CC8C%10)cc7)ccc65)cc4)c4ccc5c(c4)-c4ccccc4C54C5CC6CC7CC4C7(C6)C5)cc32)cc1
InChIInChI=1S/C170H125N7OS/c1-2-23-112(24-3-1)177-150-40-15-7-28-131(150)134-70-65-123(93-157(134)177)172(121-68-73-148-140(91-121)129-26-5-13-38-145(129)169(148)110-84-101-82-106-88-161(169)166(106,95-101)97-110)116-57-61-118(62-58-116)175-151-41-16-8-29-132(151)142-86-104(49-75-154(142)175)125-33-21-44-156-163(125)137-32-10-18-43-153(137)176(156)119-63-55-115(56-64-119)171(120-67-72-147-139(90-120)128-25-4-12-37-144(128)168(147)108-78-99-77-100(80-108)81-109(168)79-99)114-53-59-117(60-54-114)174-152-42-17-9-30-133(152)143-87-105(50-76-155(143)174)126-34-22-45-158-164(126)138-36-20-35-127(165(138)178-158)103-47-51-113(52-48-103)173(124-66-71-136-135-31-11-19-46-159(135)179-160(136)94-124)122-69-74-149-141(92-122)130-27-6-14-39-146(130)170(149)111-85-102-83-107-89-162(170)167(107,96-102)98-111/h1-76,86-87,90-94,99-102,106-111,161-162H,77-85,88-89,95-98H2
InChIKeyWBJPOMWLAAEKSY-UHFFFAOYSA-N
MW2313.98 g/mol
LogP44.92
Rot. Bonds16

About N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine

N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine (PubChem CID 156568070) has the molecular formula C170H125N7OS and a molecular weight of 2313.98 g/mol. Its IUPAC name is N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine.

Molecular Properties

Compound NameN-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine
PubChem CID156568070
Molecular FormulaC170H125N7OS
Molecular Weight2313.98 g/mol
Exact Mass2311.97
IUPAC NameN-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine
SMILESc1ccc(-n2c3ccccc3c3ccc(N(c4ccc(-n5c6ccccc6c6cc(-c7cccc8c7c7ccccc7n8-c7ccc(N(c8ccc(-n9c%10ccccc%10c%10cc(-c%11cccc%12oc%13c(-c%14ccc(N(c%15ccc%16c(c%15)-c%15ccccc%15C%16%15C%16CC%17CC%18CC%15C%18(C%17)C%16)c%15ccc%16c(c%15)sc%15ccccc%15%16)cc%14)cccc%13c%11%12)ccc%109)cc8)c8ccc9c(c8)-c8ccccc8C98C9CC%10CC(C9)CC8C%10)cc7)ccc65)cc4)c4ccc5c(c4)-c4ccccc4C54C5CC6CC7CC4C7(C6)C5)cc32)cc1
InChIInChI=1S/C170H125N7OS/c1-2-23-112(24-3-1)177-150-40-15-7-28-131(150)134-70-65-123(93-157(134)177)172(121-68-73-148-140(91-121)129-26-5-13-38-145(129)169(148)110-84-101-82-106-88-161(169)166(106,95-101)97-110)116-57-61-118(62-58-116)175-151-41-16-8-29-132(151)142-86-104(49-75-154(142)175)125-33-21-44-156-163(125)137-32-10-18-43-153(137)176(156)119-63-55-115(56-64-119)171(120-67-72-147-139(90-120)128-25-4-12-37-144(128)168(147)108-78-99-77-100(80-108)81-109(168)79-99)114-53-59-117(60-54-114)174-152-42-17-9-30-133(152)143-87-105(50-76-155(143)174)126-34-22-45-158-164(126)138-36-20-35-127(165(138)178-158)103-47-51-113(52-48-103)173(124-66-71-136-135-31-11-19-46-159(135)179-160(136)94-124)122-69-74-149-141(92-122)130-27-6-14-39-146(130)170(149)111-85-102-83-107-89-162(170)167(107,96-102)98-111/h1-76,86-87,90-94,99-102,106-111,161-162H,77-85,88-89,95-98H2
InChIKeyWBJPOMWLAAEKSY-UHFFFAOYSA-N
XLogP44.92
TPSA42.58 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds16
Heavy Atoms179
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002313.98
LogP ≤ 544.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine with MolForge

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Related Compounds

N,N-bis(4-carbazol-9-ylphenyl)spiro[adamantane-2,9'-fluorene]-3'-amine;N-(4-carbazol-9-ylphenyl)-9-phenyl-N-spiro[adamantane-2,9'-fluorene]-3'-ylcarbazol-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-spiro[adamantane-2,9'-fluorene]-3'-yldibenzothiophen-3-amine;methane
CID 163790802
9-phenyl-N-(9-phenylcarbazol-2-yl)-7-[4-[3-[(9-phenylcarbazol-2-yl)-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylamino]carbazol-9-yl]phenyl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylcarbazol-2-amine
CID 156568063
N-(4-carbazol-9-ylphenyl)-N-spiro[adamantane-2,9'-fluorene]-3'-yldibenzofuran-3-amine;N-dibenzofuran-3-yl-9-phenyl-N-spiro[adamantane-2,9'-fluorene]-3'-ylcarbazol-2-amine;N-dibenzofuran-3-yl-9-phenyl-N-spiro[adamantane-2,9'-fluorene]-3'-ylcarbazol-3-amine;N-dibenzofuran-3-yl-N-spiro[adamantane-2,9'-fluorene]-3'-yldibenzofuran-3-amine;N-dibenzothiophen-3-yl-N-spiro[adamantane-2,9'-fluorene]-3'-yldibenzofuran-3-amine
CID 163969722
9-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine
CID 156567473
N-dibenzofuran-3-yl-9-phenyl-N-(4-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylphenyl)carbazol-2-amine
CID 156567588
N-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)spiro[adamantane-2,9'-fluorene]-3'-amine
CID 156573768
N-(4-carbazol-9-ylphenyl)-N-naphthalen-2-ylspiro[adamantane-2,9'-fluorene]-3'-amine;N,N-dinaphthalen-2-ylspiro[adamantane-2,9'-fluorene]-3'-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[adamantane-2,9'-fluorene]-3'-ylcarbazol-2-amine;N-naphthalen-2-yl-N-spiro[adamantane-2,9'-fluorene]-3'-yldibenzofuran-3-amine;N-naphthalen-2-yl-N-spiro[adamantane-2,9'-fluorene]-3'-yldibenzothiophen-3-amine
CID 163899545
N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)-7-spiro[adamantane-2,9'-fluorene]-3'-yldibenzothiophen-2-amine;9-phenyl-N,N-bis(4-phenylphenyl)-6-spiro[adamantane-2,9'-fluorene]-3'-ylcarbazol-3-amine;9-phenyl-N,N-bis(4-phenylphenyl)-7-spiro[adamantane-2,9'-fluorene]-1'-ylcarbazol-3-amine
CID 159384155
N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylphenyl)aniline
CID 156567839
N,9-diphenyl-N-spiro[adamantane-2,9'-fluorene]-3'-ylcarbazol-2-amine
CID 156568137
N-[4-(9H-fluoren-9-yl)phenyl]-N-(4-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)naphthalen-2-amine;N-naphthalen-2-yl-9-phenyl-N-(4-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)carbazol-2-amine;N-naphthalen-2-yl-N-(4-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzothiophen-3-amine
CID 163673902
N-(4-phenylphenyl)-N-[4-[4-(3-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylphenyl)phenyl]phenyl]dibenzothiophen-2-amine
CID 156568159

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine?
The IUPAC name of N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine (CID 156568070) is N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine.
What is the SMILES notation for N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine?
The canonical SMILES for N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine is c1ccc(-n2c3ccccc3c3ccc(N(c4ccc(-n5c6ccccc6c6cc(-c7cccc8c7c7ccccc7n8-c7ccc(N(c8ccc(-n9c%10ccccc%10c%10cc(-c%11cccc%12oc%13c(-c%14ccc(N(c%15ccc%16c(c%15)-c%15ccccc%15C%16%15C%16CC%17CC%18CC%15C%18(C%17)C%16)c%15ccc%16c(c%15)sc%15ccccc%15%16)cc%14)cccc%13c%11%12)ccc%109)cc8)c8ccc9c(c8)-c8ccccc8C98C9CC%10CC(C9)CC8C%10)cc7)ccc65)cc4)c4ccc5c(c4)-c4ccccc4C54C5CC6CC7CC4C7(C6)C5)cc32)cc1.
What is the InChIKey of N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine?
The InChIKey is WBJPOMWLAAEKSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C170H125N7OS/c1-2-23-112(24-3-1)177-150-40-15-7-28-131(150)134-70-65-123(93-157(134)177)172(121-68-73-148-140(91-121)129-26-5-13-38-145(129)169(148)110-84-101-82-106-88-161(169)166(106,95-101)97-110)116-57-61-118(62-58-116)175-151-41-16-8-29-132(151)142-86-104(49-75-154(142)175)125-33-21-44-156-163(125)137-32-10-18-43-153(137)176(156)119-63-55-115(56-64-119)171(120-67-72-147-139(90-120)128-25-4-12-37-144(128)168(147)108-78-99-77-100(80-108)81-109(168)79-99)114-53-59-117(60-54-114)174-152-42-17-9-30-133(152)143-87-105(50-76-155(143)174)126-34-22-45-158-164(126)138-36-20-35-127(165(138)178-158)103-47-51-113(52-48-103)173(124-66-71-136-135-31-11-19-46-159(135)179-160(136)94-124)122-69-74-149-141(92-122)130-27-6-14-39-146(130)170(149)111-85-102-83-107-89-162(170)167(107,96-102)98-111/h1-76,86-87,90-94,99-102,106-111,161-162H,77-85,88-89,95-98H2.
What are the key properties of N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine?
N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine has a molecular weight of 2313.98 g/mol, XLogP of 44.92, 16 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-[9-[4-[4-[3-[6-[4-[dibenzothiophen-3-yl(spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-yl)amino]phenyl]dibenzofuran-1-yl]carbazol-9-yl]-N-spiro[adamantane-2,9'-fluorene]-3'-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]phenyl]-9-phenyl-N-spiro[fluorene-9,2'-tetracyclo[5.3.1.03,9.05,9]undecane]-3-ylcarbazol-2-amine is sourced from PubChem (CID 156568070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).