3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine

C240H160N12O2S2 — CID 157334984

IUPAC3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine
SMILESc1ccc(-c2ccc(-n3c4ccc(-c5ccc(N6c7ccccc7Oc7ccccc76)cc5)cc4c4cc(-c5ccc(N6c7ccccc7Oc7ccccc76)cc5)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccc(-c5ccc(N6c7ccccc7Sc7ccccc76)cc5)cc4c4cc(-c5ccc(N6c7ccccc7Sc7ccccc76)cc5)ccc43)cc2)cc1.c1ccc(-c2ccccc2-n2c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1.c1ccc(-c2ccccc2-n2c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc32)cc1
InChIInChI=1S/C60H39N3O2.C60H39N3S2.C60H39N3.C60H43N3/c2*1-2-12-40(13-3-1)41-22-30-46(31-23-41)61-51-36-28-44(42-24-32-47(33-25-42)62-53-14-4-8-18-57(53)64-58-19-9-5-15-54(58)62)38-49(51)50-39-45(29-37-52(50)61)43-26-34-48(35-27-43)63-55-16-6-10-20-59(55)65-60-21-11-7-17-56(60)63;1-2-14-42(15-3-1)47-16-4-9-21-54(47)63-59-36-30-43(40-26-32-45(33-27-40)61-55-22-10-5-17-48(55)49-18-6-11-23-56(49)61)38-52(59)53-39-44(31-37-60(53)63)41-28-34-46(35-29-41)62-57-24-12-7-19-50(57)51-20-8-13-25-58(51)62;1-6-18-46(19-7-1)55-28-16-17-29-58(55)63-59-40-34-47(44-30-36-53(37-31-44)61(49-20-8-2-9-21-49)50-22-10-3-11-23-50)42-56(59)57-43-48(35-41-60(57)63)45-32-38-54(39-33-45)62(51-24-12-4-13-25-51)52-26-14-5-15-27-52/h2*1-39H;1-39H;1-43H
InChIKeyBFSTYXSHDXDKDS-UHFFFAOYSA-N
MW3308.14 g/mol
LogP67.29
Rot. Bonds28

About 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine

3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine (PubChem CID 157334984) has the molecular formula C240H160N12O2S2 and a molecular weight of 3308.14 g/mol. Its IUPAC name is 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine.

Molecular Properties

Compound Name3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine
PubChem CID157334984
Molecular FormulaC240H160N12O2S2
Molecular Weight3308.14 g/mol
Exact Mass3305.22
IUPAC Name3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine
SMILESc1ccc(-c2ccc(-n3c4ccc(-c5ccc(N6c7ccccc7Oc7ccccc76)cc5)cc4c4cc(-c5ccc(N6c7ccccc7Oc7ccccc76)cc5)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccc(-c5ccc(N6c7ccccc7Sc7ccccc76)cc5)cc4c4cc(-c5ccc(N6c7ccccc7Sc7ccccc76)cc5)ccc43)cc2)cc1.c1ccc(-c2ccccc2-n2c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1.c1ccc(-c2ccccc2-n2c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc32)cc1
InChIInChI=1S/C60H39N3O2.C60H39N3S2.C60H39N3.C60H43N3/c2*1-2-12-40(13-3-1)41-22-30-46(31-23-41)61-51-36-28-44(42-24-32-47(33-25-42)62-53-14-4-8-18-57(53)64-58-19-9-5-15-54(58)62)38-49(51)50-39-45(29-37-52(50)61)43-26-34-48(35-27-43)63-55-16-6-10-20-59(55)65-60-21-11-7-17-56(60)63;1-2-14-42(15-3-1)47-16-4-9-21-54(47)63-59-36-30-43(40-26-32-45(33-27-40)61-55-22-10-5-17-48(55)49-18-6-11-23-56(49)61)38-52(59)53-39-44(31-37-60(53)63)41-28-34-46(35-29-41)62-57-24-12-7-19-50(57)51-20-8-13-25-58(51)62;1-6-18-46(19-7-1)55-28-16-17-29-58(55)63-59-40-34-47(44-30-36-53(37-31-44)61(49-20-8-2-9-21-49)50-22-10-3-11-23-50)42-56(59)57-43-48(35-41-60(57)63)45-32-38-54(39-33-45)62(51-24-12-4-13-25-51)52-26-14-5-15-27-52/h2*1-39H;1-39H;1-43H
InChIKeyBFSTYXSHDXDKDS-UHFFFAOYSA-N
XLogP67.29
TPSA67.48 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds28
Heavy Atoms256
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003308.14
LogP ≤ 567.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine with MolForge

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Related Compounds

9-[2-[2-Carbazol-9-yl-5-(trifluoromethyl)phenyl]-4-(trifluoromethyl)phenyl]carbazole;3-[4-[5-cyano-2-(3,6-ditert-butylcarbazol-9-yl)phenyl]phenyl]-4-(3,6-ditert-butylcarbazol-9-yl)benzonitrile;3-[4-[5-cyano-2-(9,9-dimethylacridin-10-yl)phenyl]-2,5-dimethylphenyl]-4-(9,9-dimethylacridin-10-yl)benzonitrile;3-[4-(5-cyano-2-phenoxazin-10-ylphenyl)-2,5-dimethylphenyl]-4-phenoxazin-10-ylbenzonitrile;3,6-ditert-butyl-9-[2-[2-(3,6-dimethylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-4-(trifluoromethyl)phenyl]carbazole
CID 157743145
2-carbazol-9-yl-N,N-dimethyl-3-phenyl-5-(trifluoromethyl)aniline;9,9-dimethyl-10-[2-phenyl-4-(trifluoromethyl)phenyl]acridine;bis(9-[2-methyl-6-phenyl-4-(trifluoromethyl)phenyl]carbazole);10-[2-methyl-6-phenyl-4-(trifluoromethyl)phenyl]phenoxazine;bis(9-[2-methyl-6-thiophen-2-yl-4-(trifluoromethyl)phenyl]carbazole);tris(9-[2-methyl-4-(trifluoromethyl)phenyl]carbazole);9-[2-phenyl-6-thiophen-2-yl-4-(trifluoromethyl)phenyl]carbazole;9-[2-phenyl-4-(trifluoromethyl)phenyl]carbazole
CID 159908390
3,6-Ditert-butyl-9-[2-phenyl-6-thiophen-2-yl-4-(trifluoromethyl)phenyl]carbazole;bis(9,9-dimethyl-10-[2-methyl-4-(trifluoromethyl)phenyl]acridine);bis(10-[2,6-dimethyl-4-(trifluoromethyl)phenyl]phenoxazine);10-[2-methoxy-6-methyl-4-(trifluoromethyl)phenyl]phenoxazine;10-[2-methoxy-6-phenyl-4-(trifluoromethyl)phenyl]-9,9-dimethylacridine;10-[2-methoxy-6-thiophen-2-yl-4-(trifluoromethyl)phenyl]-9,9-dimethylacridine;10-[2-methoxy-4-(trifluoromethyl)phenyl]phenoxazine
CID 160844257
2,6-Di(carbazol-9-yl)-4-phenoxazin-10-ylbenzonitrile
CID 168340288
10-Phenyl-3-[12-(10-phenylphenothiazin-3-yl)indolo[3,2-c]carbazol-5-yl]phenoxazine
CID 58029157
10-Phenyl-3-(9-phenylcarbazol-3-yl)-7-(10-phenylphenothiazin-3-yl)phenoxazine
CID 68112353
10-Phenyl-3-[10-phenyl-7-(9-phenylcarbazol-3-yl)phenothiazin-3-yl]phenoxazine
CID 68112355
10-Phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine
CID 68112364
10-[4-(7,7-Dimethyl-5-thia-1-azapentacyclo[10.6.1.02,6.08,19.013,18]nonadeca-2(6),3,8,10,12(19),13(18),14,16-octaen-15-yl)phenyl]phenoxazine
CID 71023391
3,6-Dimethyl-9-(4-methylphenyl)carbazole;3,7-dimethyl-10-(4-methylphenyl)phenothiazine;10-methylphenoxazine;9-(4-methylphenyl)carbazole;10-(4-methylphenyl)phenothiazine;3,7,10-trimethylphenoxazine
CID 91048214
10-[5-(1,3-Benzothiazol-2-yl)-2-[4-(1,3-benzothiazol-2-yl)-2-phenoxazin-10-ylphenyl]phenyl]phenoxazine
CID 129148069
10-[3-(1,3-Benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenoxazin-10-ylphenyl]phenyl]phenoxazine
CID 129148083

Frequently Asked Questions

What is the IUPAC name of 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine?
The IUPAC name of 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine (CID 157334984) is 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine.
What is the SMILES notation for 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine?
The canonical SMILES for 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine is c1ccc(-c2ccc(-n3c4ccc(-c5ccc(N6c7ccccc7Oc7ccccc76)cc5)cc4c4cc(-c5ccc(N6c7ccccc7Oc7ccccc76)cc5)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccc(-c5ccc(N6c7ccccc7Sc7ccccc76)cc5)cc4c4cc(-c5ccc(N6c7ccccc7Sc7ccccc76)cc5)ccc43)cc2)cc1.c1ccc(-c2ccccc2-n2c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc32)cc1.c1ccc(-c2ccccc2-n2c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc32)cc1.
What is the InChIKey of 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine?
The InChIKey is BFSTYXSHDXDKDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H39N3O2.C60H39N3S2.C60H39N3.C60H43N3/c2*1-2-12-40(13-3-1)41-22-30-46(31-23-41)61-51-36-28-44(42-24-32-47(33-25-42)62-53-14-4-8-18-57(53)64-58-19-9-5-15-54(58)62)38-49(51)50-39-45(29-37-52(50)61)43-26-34-48(35-27-43)63-55-16-6-10-20-59(55)65-60-21-11-7-17-56(60)63;1-2-14-42(15-3-1)47-16-4-9-21-54(47)63-59-36-30-43(40-26-32-45(33-27-40)61-55-22-10-5-17-48(55)49-18-6-11-23-56(49)61)38-52(59)53-39-44(31-37-60(53)63)41-28-34-46(35-29-41)62-57-24-12-7-19-50(57)51-20-8-13-25-58(51)62;1-6-18-46(19-7-1)55-28-16-17-29-58(55)63-59-40-34-47(44-30-36-53(37-31-44)61(49-20-8-2-9-21-49)50-22-10-3-11-23-50)42-56(59)57-43-48(35-41-60(57)63)45-32-38-54(39-33-45)62(51-24-12-4-13-25-51)52-26-14-5-15-27-52/h2*1-39H;1-39H;1-43H.
What are the key properties of 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine?
3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine has a molecular weight of 3308.14 g/mol, XLogP of 67.29, 28 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(4-carbazol-9-ylphenyl)-9-(2-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(2-phenylphenyl)carbazol-3-yl]aniline;10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine;10-[4-[6-(4-phenoxazin-10-ylphenyl)-9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenoxazine is sourced from PubChem (CID 157334984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).