1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine

C318H214N12 — CID 157297321

IUPAC1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
SMILESc1ccc(-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3n4-c3ccc(-c4ccc(N(c5ccccc5)c5cc(N(c6ccccc6)c6ccc(-n7c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8c8cc(-c9ccc(-c%10ccccc%10)cc9)ccc87)cc6)cc(N(c6ccccc6)c6ccc(-n7c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8c8cc(-c9ccc(-c%10ccccc%10)cc9)ccc87)cc6)c5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3n4-c3ccc(N(c4ccccc4)c4cc(N(c5ccccc5)c5ccc(-n6c7ccc(-c8ccc(-c9ccccc9)cc8)cc7c7cc(-c8ccc(-c9ccccc9)cc8)ccc76)c6ccccc56)cc(N(c5ccccc5)c5ccc(-n6c7ccc(-c8ccc(-c9ccccc9)cc8)cc7c7cc(-c8ccc(-c9ccccc9)cc8)ccc76)c6ccccc56)c4)c4ccccc34)cc2)cc1
InChIInChI=1S/C162H108N6.C156H106N6/c1-10-34-109(35-11-1)115-58-70-121(71-59-115)127-82-88-157-145(100-127)146-101-128(122-72-60-116(61-73-122)110-36-12-2-13-37-110)83-89-158(146)166(157)154-97-94-151(139-52-28-31-55-142(139)154)163(133-46-22-7-23-47-133)136-106-137(164(134-48-24-8-25-49-134)152-95-98-155(143-56-32-29-53-140(143)152)167-159-90-84-129(123-74-62-117(63-75-123)111-38-14-3-15-39-111)102-147(159)148-103-130(85-91-160(148)167)124-76-64-118(65-77-124)112-40-16-4-17-41-112)108-138(107-136)165(135-50-26-9-27-51-135)153-96-99-156(144-57-33-30-54-141(144)153)168-161-92-86-131(125-78-66-119(67-79-125)113-42-18-5-19-43-113)104-149(161)150-105-132(87-93-162(150)168)126-80-68-120(69-81-126)114-44-20-6-21-45-114;1-10-28-107(29-11-1)113-46-58-121(59-47-113)127-74-92-151-145(98-127)146-99-128(122-60-48-114(49-61-122)108-30-12-2-13-31-108)75-93-152(146)160(151)139-82-72-120(73-83-139)119-70-80-136(81-71-119)157(133-40-22-7-23-41-133)142-104-143(158(134-42-24-8-25-43-134)137-84-88-140(89-85-137)161-153-94-76-129(123-62-50-115(51-63-123)109-32-14-3-15-33-109)100-147(153)148-101-130(77-95-154(148)161)124-64-52-116(53-65-124)110-34-16-4-17-35-110)106-144(105-142)159(135-44-26-9-27-45-135)138-86-90-141(91-87-138)162-155-96-78-131(125-66-54-117(55-67-125)111-36-18-5-19-37-111)102-149(155)150-103-132(79-97-156(150)162)126-68-56-118(57-69-126)112-38-20-6-21-39-112/h1-108H;1-106H
InChIKeyBBMKKKJCJALZSC-UHFFFAOYSA-N
MW4203.29 g/mol
LogP87.91
Rot. Bonds49

About 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine

1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine (PubChem CID 157297321) has the molecular formula C318H214N12 and a molecular weight of 4203.29 g/mol. Its IUPAC name is 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine.

Molecular Properties

Compound Name1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
PubChem CID157297321
Molecular FormulaC318H214N12
Molecular Weight4203.29 g/mol
Exact Mass4199.71
IUPAC Name1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
SMILESc1ccc(-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3n4-c3ccc(-c4ccc(N(c5ccccc5)c5cc(N(c6ccccc6)c6ccc(-n7c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8c8cc(-c9ccc(-c%10ccccc%10)cc9)ccc87)cc6)cc(N(c6ccccc6)c6ccc(-n7c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8c8cc(-c9ccc(-c%10ccccc%10)cc9)ccc87)cc6)c5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3n4-c3ccc(N(c4ccccc4)c4cc(N(c5ccccc5)c5ccc(-n6c7ccc(-c8ccc(-c9ccccc9)cc8)cc7c7cc(-c8ccc(-c9ccccc9)cc8)ccc76)c6ccccc56)cc(N(c5ccccc5)c5ccc(-n6c7ccc(-c8ccc(-c9ccccc9)cc8)cc7c7cc(-c8ccc(-c9ccccc9)cc8)ccc76)c6ccccc56)c4)c4ccccc34)cc2)cc1
InChIInChI=1S/C162H108N6.C156H106N6/c1-10-34-109(35-11-1)115-58-70-121(71-59-115)127-82-88-157-145(100-127)146-101-128(122-72-60-116(61-73-122)110-36-12-2-13-37-110)83-89-158(146)166(157)154-97-94-151(139-52-28-31-55-142(139)154)163(133-46-22-7-23-47-133)136-106-137(164(134-48-24-8-25-49-134)152-95-98-155(143-56-32-29-53-140(143)152)167-159-90-84-129(123-74-62-117(63-75-123)111-38-14-3-15-39-111)102-147(159)148-103-130(85-91-160(148)167)124-76-64-118(65-77-124)112-40-16-4-17-41-112)108-138(107-136)165(135-50-26-9-27-51-135)153-96-99-156(144-57-33-30-54-141(144)153)168-161-92-86-131(125-78-66-119(67-79-125)113-42-18-5-19-43-113)104-149(161)150-105-132(87-93-162(150)168)126-80-68-120(69-81-126)114-44-20-6-21-45-114;1-10-28-107(29-11-1)113-46-58-121(59-47-113)127-74-92-151-145(98-127)146-99-128(122-60-48-114(49-61-122)108-30-12-2-13-31-108)75-93-152(146)160(151)139-82-72-120(73-83-139)119-70-80-136(81-71-119)157(133-40-22-7-23-41-133)142-104-143(158(134-42-24-8-25-43-134)137-84-88-140(89-85-137)161-153-94-76-129(123-62-50-115(51-63-123)109-32-14-3-15-33-109)100-147(153)148-101-130(77-95-154(148)161)124-64-52-116(53-65-124)110-34-16-4-17-35-110)106-144(105-142)159(135-44-26-9-27-45-135)138-86-90-141(91-87-138)162-155-96-78-131(125-66-54-117(55-67-125)111-36-18-5-19-37-111)102-149(155)150-103-132(79-97-156(150)162)126-68-56-118(57-69-126)112-38-20-6-21-39-112/h1-108H;1-106H
InChIKeyBBMKKKJCJALZSC-UHFFFAOYSA-N
XLogP87.91
TPSA49.02 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds49
Heavy Atoms330
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004203.29
LogP ≤ 587.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine with MolForge

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Related Compounds

1-N,3-N,5-N-tris[4-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
CID 59815961
N-phenyl-4-(4-phenylphenyl)-N-[4-[6-phenyl-9-[4-(4-phenylphenyl)phenyl]carbazol-3-yl]phenyl]aniline
CID 122524703
3,6-bis(4-carbazol-9-ylphenyl)-9-(4-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(4-phenylphenyl)carbazol-3-yl]aniline
CID 158023150
1-N,3-N-bis[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine
CID 59816026
N-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 121312844
4-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]naphthalen-1-amine
CID 89212986
1-N,3-N,5-N-tris[6,9-bis(4-phenylphenyl)carbazol-3-yl]-1-N,3-N-dinaphthalen-1-yl-5-N-phenylbenzene-1,3,5-triamine
CID 88673324
1-N,1-N,3-N,3-N-tetraphenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine
CID 70645467
2-(3,6-diphenylcarbazol-9-yl)-4-phenyl-N,N-bis(4-phenylphenyl)aniline
CID 177073316
1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylnaphthalen-1-yl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine
CID 129175584
4-phenyl-2-(3-phenylcarbazol-9-yl)-N,N-bis(4-phenylphenyl)aniline
CID 177073320
N-[4-[4-(3-phenylcarbazol-9-yl)phenyl]phenyl]-3-(4-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]aniline
CID 121312772

Frequently Asked Questions

What is the IUPAC name of 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine?
The IUPAC name of 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine (CID 157297321) is 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine.
What is the SMILES notation for 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine?
The canonical SMILES for 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine is c1ccc(-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3n4-c3ccc(-c4ccc(N(c5ccccc5)c5cc(N(c6ccccc6)c6ccc(-n7c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8c8cc(-c9ccc(-c%10ccccc%10)cc9)ccc87)cc6)cc(N(c6ccccc6)c6ccc(-n7c8ccc(-c9ccc(-c%10ccccc%10)cc9)cc8c8cc(-c9ccc(-c%10ccccc%10)cc9)ccc87)cc6)c5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3n4-c3ccc(N(c4ccccc4)c4cc(N(c5ccccc5)c5ccc(-n6c7ccc(-c8ccc(-c9ccccc9)cc8)cc7c7cc(-c8ccc(-c9ccccc9)cc8)ccc76)c6ccccc56)cc(N(c5ccccc5)c5ccc(-n6c7ccc(-c8ccc(-c9ccccc9)cc8)cc7c7cc(-c8ccc(-c9ccccc9)cc8)ccc76)c6ccccc56)c4)c4ccccc34)cc2)cc1.
What is the InChIKey of 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine?
The InChIKey is BBMKKKJCJALZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C162H108N6.C156H106N6/c1-10-34-109(35-11-1)115-58-70-121(71-59-115)127-82-88-157-145(100-127)146-101-128(122-72-60-116(61-73-122)110-36-12-2-13-37-110)83-89-158(146)166(157)154-97-94-151(139-52-28-31-55-142(139)154)163(133-46-22-7-23-47-133)136-106-137(164(134-48-24-8-25-49-134)152-95-98-155(143-56-32-29-53-140(143)152)167-159-90-84-129(123-74-62-117(63-75-123)111-38-14-3-15-39-111)102-147(159)148-103-130(85-91-160(148)167)124-76-64-118(65-77-124)112-40-16-4-17-41-112)108-138(107-136)165(135-50-26-9-27-51-135)153-96-99-156(144-57-33-30-54-141(144)153)168-161-92-86-131(125-78-66-119(67-79-125)113-42-18-5-19-43-113)104-149(161)150-105-132(87-93-162(150)168)126-80-68-120(69-81-126)114-44-20-6-21-45-114;1-10-28-107(29-11-1)113-46-58-121(59-47-113)127-74-92-151-145(98-127)146-99-128(122-60-48-114(49-61-122)108-30-12-2-13-31-108)75-93-152(146)160(151)139-82-72-120(73-83-139)119-70-80-136(81-71-119)157(133-40-22-7-23-41-133)142-104-143(158(134-42-24-8-25-43-134)137-84-88-140(89-85-137)161-153-94-76-129(123-62-50-115(51-63-123)109-32-14-3-15-33-109)100-147(153)148-101-130(77-95-154(148)161)124-64-52-116(53-65-124)110-34-16-4-17-35-110)106-144(105-142)159(135-44-26-9-27-45-135)138-86-90-141(91-87-138)162-155-96-78-131(125-66-54-117(55-67-125)111-36-18-5-19-37-111)102-149(155)150-103-132(79-97-156(150)162)126-68-56-118(57-69-126)112-38-20-6-21-39-112/h1-108H;1-106H.
What are the key properties of 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine?
1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine has a molecular weight of 4203.29 g/mol, XLogP of 87.91, 49 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,3-N-bis[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]-5-N-[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine;1-N,3-N,5-N-tris[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]naphthalen-1-yl]-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine is sourced from PubChem (CID 157297321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).