3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole

C258H210N12 — CID 59561667

IUPAC3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole
SMILESCCCCC(CC)Cn1c2ccc(-c3cc(-c4ccc5c(c4)c4cc(C6(c7ccc8c(c7)c7cc(-c9ccc(-c%10cncc(-c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%10)cc9)ccc7n8-c7ccc(C(C)(C)C)cc7)c7ccccc7-c7ccccc76)ccc4n5CC(CC)CCCC)cc(-c4ccc5c(c4)c4cc(C6(c7ccc8c(c7)c7cc(-c9ccc(-c%10cncc(-c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%10)cc9)ccc7n8-c7ccc(C(C)(C)C)cc7)c7ccccc7-c7ccccc76)ccc4n5CC(CC)CCCC)c3)cc2c2cc(C3(c4ccc5c(c4)c4cc(-c6ccc(-c7cncc(-c8ccc(-n9c%10ccccc%10c%10ccccc%109)cc8)c7)cc6)ccc4n5-c4ccc(C(C)(C)C)cc4)c4ccccc4-c4ccccc43)ccc21
InChIInChI=1S/C258H210N12/c1-16-22-49-163(19-4)160-262-235-124-94-178(145-217(235)223-148-193(106-130-238(223)262)256(229-64-37-25-52-205(229)206-53-26-38-65-230(206)256)196-109-133-250-226(151-196)220-142-175(97-127-247(220)268(250)202-118-100-190(101-119-202)253(7,8)9)166-76-82-169(83-77-166)184-139-187(157-259-154-184)172-88-112-199(113-89-172)265-241-70-43-31-58-211(241)212-59-32-44-71-242(212)265)181-136-182(179-95-125-236-218(146-179)224-149-194(107-131-239(224)263(236)161-164(20-5)50-23-17-2)257(231-66-39-27-54-207(231)208-55-28-40-67-232(208)257)197-110-134-251-227(152-197)221-143-176(98-128-248(221)269(251)203-120-102-191(103-121-203)254(10,11)12)167-78-84-170(85-79-167)185-140-188(158-260-155-185)173-90-114-200(115-91-173)266-243-72-45-33-60-213(243)214-61-34-46-73-244(214)266)138-183(137-181)180-96-126-237-219(147-180)225-150-195(108-132-240(225)264(237)162-165(21-6)51-24-18-3)258(233-68-41-29-56-209(233)210-57-30-42-69-234(210)258)198-111-135-252-228(153-198)222-144-177(99-129-249(222)270(252)204-122-104-192(105-123-204)255(13,14)15)168-80-86-171(87-81-168)186-141-189(159-261-156-186)174-92-116-201(117-93-174)267-245-74-47-35-62-215(245)216-63-36-48-75-246(216)267/h25-48,52-159,163-165H,16-24,49-51,160-162H2,1-15H3
InChIKeyDRCIOBKYMUATMD-UHFFFAOYSA-N
MW3478.60 g/mol
LogP68.41
Rot. Bonds42

About 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole

3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole (PubChem CID 59561667) has the molecular formula C258H210N12 and a molecular weight of 3478.60 g/mol. Its IUPAC name is 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole.

Molecular Properties

Compound Name3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole
PubChem CID59561667
Molecular FormulaC258H210N12
Molecular Weight3478.60 g/mol
Exact Mass3475.68
IUPAC Name3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole
SMILESCCCCC(CC)Cn1c2ccc(-c3cc(-c4ccc5c(c4)c4cc(C6(c7ccc8c(c7)c7cc(-c9ccc(-c%10cncc(-c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%10)cc9)ccc7n8-c7ccc(C(C)(C)C)cc7)c7ccccc7-c7ccccc76)ccc4n5CC(CC)CCCC)cc(-c4ccc5c(c4)c4cc(C6(c7ccc8c(c7)c7cc(-c9ccc(-c%10cncc(-c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%10)cc9)ccc7n8-c7ccc(C(C)(C)C)cc7)c7ccccc7-c7ccccc76)ccc4n5CC(CC)CCCC)c3)cc2c2cc(C3(c4ccc5c(c4)c4cc(-c6ccc(-c7cncc(-c8ccc(-n9c%10ccccc%10c%10ccccc%109)cc8)c7)cc6)ccc4n5-c4ccc(C(C)(C)C)cc4)c4ccccc4-c4ccccc43)ccc21
InChIInChI=1S/C258H210N12/c1-16-22-49-163(19-4)160-262-235-124-94-178(145-217(235)223-148-193(106-130-238(223)262)256(229-64-37-25-52-205(229)206-53-26-38-65-230(206)256)196-109-133-250-226(151-196)220-142-175(97-127-247(220)268(250)202-118-100-190(101-119-202)253(7,8)9)166-76-82-169(83-77-166)184-139-187(157-259-154-184)172-88-112-199(113-89-172)265-241-70-43-31-58-211(241)212-59-32-44-71-242(212)265)181-136-182(179-95-125-236-218(146-179)224-149-194(107-131-239(224)263(236)161-164(20-5)50-23-17-2)257(231-66-39-27-54-207(231)208-55-28-40-67-232(208)257)197-110-134-251-227(152-197)221-143-176(98-128-248(221)269(251)203-120-102-191(103-121-203)254(10,11)12)167-78-84-170(85-79-167)185-140-188(158-260-155-185)173-90-114-200(115-91-173)266-243-72-45-33-60-213(243)214-61-34-46-73-244(214)266)138-183(137-181)180-96-126-237-219(147-180)225-150-195(108-132-240(225)264(237)162-165(21-6)51-24-18-3)258(233-68-41-29-56-209(233)210-57-30-42-69-234(210)258)198-111-135-252-228(153-198)222-144-177(99-129-249(222)270(252)204-122-104-192(105-123-204)255(13,14)15)168-80-86-171(87-81-168)186-141-189(159-261-156-186)174-92-116-201(117-93-174)267-245-74-47-35-62-215(245)216-63-36-48-75-246(216)267/h25-48,52-159,163-165H,16-24,49-51,160-162H2,1-15H3
InChIKeyDRCIOBKYMUATMD-UHFFFAOYSA-N
XLogP68.41
TPSA83.04 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds42
Heavy Atoms270
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003478.60
LogP ≤ 568.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-tert-butylphenyl)-N-[4-[9-[9-(4-tert-butylphenyl)-6-[9-[4-(N-(4-tert-butylphenyl)anilino)phenyl]fluoren-9-yl]carbazol-3-yl]fluoren-9-yl]phenyl]-4-[9-(2-ethylhexyl)carbazol-3-yl]aniline
CID 59404168
3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-phenylcarbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-phenylcarbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole;tris(2-methylpyridine)
CID 158708477
N-[4-[4-[4-[9-[4-(N-(4-tert-butylphenyl)anilino)phenyl]fluoren-9-yl]-N-[4-[9-[4-[N-(4-tert-butylphenyl)-4-[9-(2-ethylhexyl)carbazol-3-yl]anilino]phenyl]fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 59404159
N-(4-tert-butylphenyl)-4-[9-[9-(4-tert-butylphenyl)-6-[5-[3,5-di(carbazol-9-yl)phenyl]-3-pyridinyl]carbazol-3-yl]fluoren-9-yl]-N-[4-[9-[9-(4-tert-butylphenyl)-6-[5-[3,5-di(carbazol-9-yl)phenyl]-3-pyridinyl]carbazol-3-yl]fluoren-9-yl]phenyl]aniline
CID 58151189
tris(9-(3-carbazol-9-yl-5-methylphenyl)carbazole);4-[9-(2-ethylhexyl)-6-(9-phenylfluoren-9-yl)carbazol-3-yl]-N,N-bis[4-[9-(2-ethylhexyl)-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]aniline
CID 160900828
3-[9-[9-[4-[4-[3,6-bis[9-[9-(4-tert-butylphenyl)-6-phenylcarbazol-3-yl]fluoren-9-yl]carbazol-9-yl]phenyl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-phenylcarbazol-3-yl]fluoren-9-yl]carbazol-3-yl]fluoren-9-yl]-9-(4-tert-butylphenyl)-6-phenylcarbazole
CID 59561645
3,6-ditert-butyl-9-[4-[4-[3-[9-[9-(4-tert-butylphenyl)-6-methylcarbazol-3-yl]fluoren-9-yl]-6-[9-[9-(4-tert-butylphenyl)-6-(7-methyl-9,9-dioctylfluoren-2-yl)carbazol-3-yl]fluoren-9-yl]carbazol-9-yl]phenyl]phenyl]carbazole
CID 59404178
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[4-[3-[9-[4-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590519
9-phenyl-3-(9-phenylfluoren-9-yl)-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 121311550
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573
3,6-ditert-butyl-9-[4-[9-[4-[9-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]fluoren-9-yl]phenyl]fluoren-9-yl]phenyl]carbazole
CID 91177168
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009

Frequently Asked Questions

What is the IUPAC name of 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole?
The IUPAC name of 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole (CID 59561667) is 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole.
What is the SMILES notation for 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole?
The canonical SMILES for 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole is CCCCC(CC)Cn1c2ccc(-c3cc(-c4ccc5c(c4)c4cc(C6(c7ccc8c(c7)c7cc(-c9ccc(-c%10cncc(-c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%10)cc9)ccc7n8-c7ccc(C(C)(C)C)cc7)c7ccccc7-c7ccccc76)ccc4n5CC(CC)CCCC)cc(-c4ccc5c(c4)c4cc(C6(c7ccc8c(c7)c7cc(-c9ccc(-c%10cncc(-c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%10)cc9)ccc7n8-c7ccc(C(C)(C)C)cc7)c7ccccc7-c7ccccc76)ccc4n5CC(CC)CCCC)c3)cc2c2cc(C3(c4ccc5c(c4)c4cc(-c6ccc(-c7cncc(-c8ccc(-n9c%10ccccc%10c%10ccccc%109)cc8)c7)cc6)ccc4n5-c4ccc(C(C)(C)C)cc4)c4ccccc4-c4ccccc43)ccc21.
What is the InChIKey of 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole?
The InChIKey is DRCIOBKYMUATMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C258H210N12/c1-16-22-49-163(19-4)160-262-235-124-94-178(145-217(235)223-148-193(106-130-238(223)262)256(229-64-37-25-52-205(229)206-53-26-38-65-230(206)256)196-109-133-250-226(151-196)220-142-175(97-127-247(220)268(250)202-118-100-190(101-119-202)253(7,8)9)166-76-82-169(83-77-166)184-139-187(157-259-154-184)172-88-112-199(113-89-172)265-241-70-43-31-58-211(241)212-59-32-44-71-242(212)265)181-136-182(179-95-125-236-218(146-179)224-149-194(107-131-239(224)263(236)161-164(20-5)50-23-17-2)257(231-66-39-27-54-207(231)208-55-28-40-67-232(208)257)197-110-134-251-227(152-197)221-143-176(98-128-248(221)269(251)203-120-102-191(103-121-203)254(10,11)12)167-78-84-170(85-79-167)185-140-188(158-260-155-185)173-90-114-200(115-91-173)266-243-72-45-33-60-213(243)214-61-34-46-73-244(214)266)138-183(137-181)180-96-126-237-219(147-180)225-150-195(108-132-240(225)264(237)162-165(21-6)51-24-18-3)258(233-68-41-29-56-209(233)210-57-30-42-69-234(210)258)198-111-135-252-228(153-198)222-144-177(99-129-249(222)270(252)204-122-104-192(105-123-204)255(13,14)15)168-80-86-171(87-81-168)186-141-189(159-261-156-186)174-92-116-201(117-93-174)267-245-74-47-35-62-215(245)216-63-36-48-75-246(216)267/h25-48,52-159,163-165H,16-24,49-51,160-162H2,1-15H3.
What are the key properties of 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole?
3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole has a molecular weight of 3478.60 g/mol, XLogP of 68.41, 42 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3,5-bis[6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazol-3-yl]phenyl]-6-[9-[9-(4-tert-butylphenyl)-6-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]carbazol-3-yl]fluoren-9-yl]-9-(2-ethylhexyl)carbazole is sourced from PubChem (CID 59561667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).