4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid

C285H307Br3N6O10 — CID 163856856

IUPAC4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid
SMILESCCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3ccc(N(c4ccc(Br)cc4)c4ccc(Br)cc4)cc3)cc(/C=C/c3cccc(OCCCCCCCCCC)c3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccc(Br)cc4)cc3)cc(/C=C/c3cccc(OCCCCCCCCCC)c3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3cccc(OCCCCCCCCCC)c3)cc(/C=C/c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-n5c6ccccc6c6cc(C(=O)O)ccc65)cc4)cc3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3cccc(OCCCCCCCCCC)c3)cc(/C=C/c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c2)c1
InChIInChI=1S/C81H82N2O4.C80H82N2O2.C62H71Br2NO2.C62H72BrNO2/c1-3-5-7-9-11-13-15-21-51-86-71-27-23-25-60(56-71)33-36-63-53-64(37-34-61-26-24-28-72(57-61)87-52-22-16-14-12-10-8-6-4-2)55-65(54-63)38-35-62-39-49-79-75(58-62)73-29-17-19-31-77(73)82(79)69-45-40-66(41-46-69)67-42-47-70(48-43-67)83-78-32-20-18-30-74(78)76-59-68(81(84)85)44-50-80(76)83;1-3-5-7-9-11-13-15-23-53-83-71-29-25-27-61(58-71)37-40-64-55-65(41-38-62-28-26-30-72(59-62)84-54-24-16-14-12-10-8-6-4-2)57-66(56-64)42-39-63-43-52-80-76(60-63)75-33-19-22-36-79(75)82(80)70-50-46-68(47-51-70)67-44-48-69(49-45-67)81-77-34-20-17-31-73(77)74-32-18-21-35-78(74)81;1-3-5-7-9-11-13-15-17-43-66-61-23-19-21-51(48-61)26-29-54-45-53(46-55(47-54)30-27-52-22-20-24-62(49-52)67-44-18-16-14-12-10-8-6-4-2)28-25-50-31-37-58(38-32-50)65(59-39-33-56(63)34-40-59)60-41-35-57(64)36-42-60;1-3-5-7-9-11-13-15-20-44-65-61-28-22-24-52(49-61)31-34-55-46-54(47-56(48-55)35-32-53-25-23-29-62(50-53)66-45-21-16-14-12-10-8-6-4-2)33-30-51-36-40-59(41-37-51)64(58-26-18-17-19-27-58)60-42-38-57(63)39-43-60/h17-20,23-50,53-59H,3-16,21-22,51-52H2,1-2H3,(H,84,85);17-22,25-52,55-60H,3-16,23-24,53-54H2,1-2H3;19-42,45-49H,3-18,43-44H2,1-2H3;17-19,22-43,46-50H,3-16,20-21,44-45H2,1-2H3/b36-33+,37-34+,38-35+;40-37+,41-38+,42-39+;28-25+,29-26+,30-27+;33-30+,34-31+,35-32+
InChIKeyOZASCVROQSQZDL-UQCNKGEXSA-N
MW4216.33 g/mol
LogP85.59
Rot. Bonds117

About 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid

4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid (PubChem CID 163856856) has the molecular formula C285H307Br3N6O10 and a molecular weight of 4216.33 g/mol. Its IUPAC name is 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid.

Molecular Properties

Compound Name4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid
PubChem CID163856856
Molecular FormulaC285H307Br3N6O10
Molecular Weight4216.33 g/mol
Exact Mass4210.12
IUPAC Name4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid
SMILESCCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3ccc(N(c4ccc(Br)cc4)c4ccc(Br)cc4)cc3)cc(/C=C/c3cccc(OCCCCCCCCCC)c3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccc(Br)cc4)cc3)cc(/C=C/c3cccc(OCCCCCCCCCC)c3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3cccc(OCCCCCCCCCC)c3)cc(/C=C/c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-n5c6ccccc6c6cc(C(=O)O)ccc65)cc4)cc3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3cccc(OCCCCCCCCCC)c3)cc(/C=C/c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c2)c1
InChIInChI=1S/C81H82N2O4.C80H82N2O2.C62H71Br2NO2.C62H72BrNO2/c1-3-5-7-9-11-13-15-21-51-86-71-27-23-25-60(56-71)33-36-63-53-64(37-34-61-26-24-28-72(57-61)87-52-22-16-14-12-10-8-6-4-2)55-65(54-63)38-35-62-39-49-79-75(58-62)73-29-17-19-31-77(73)82(79)69-45-40-66(41-46-69)67-42-47-70(48-43-67)83-78-32-20-18-30-74(78)76-59-68(81(84)85)44-50-80(76)83;1-3-5-7-9-11-13-15-23-53-83-71-29-25-27-61(58-71)37-40-64-55-65(41-38-62-28-26-30-72(59-62)84-54-24-16-14-12-10-8-6-4-2)57-66(56-64)42-39-63-43-52-80-76(60-63)75-33-19-22-36-79(75)82(80)70-50-46-68(47-51-70)67-44-48-69(49-45-67)81-77-34-20-17-31-73(77)74-32-18-21-35-78(74)81;1-3-5-7-9-11-13-15-17-43-66-61-23-19-21-51(48-61)26-29-54-45-53(46-55(47-54)30-27-52-22-20-24-62(49-52)67-44-18-16-14-12-10-8-6-4-2)28-25-50-31-37-58(38-32-50)65(59-39-33-56(63)34-40-59)60-41-35-57(64)36-42-60;1-3-5-7-9-11-13-15-20-44-65-61-28-22-24-52(49-61)31-34-55-46-54(47-56(48-55)35-32-53-25-23-29-62(50-53)66-45-21-16-14-12-10-8-6-4-2)33-30-51-36-40-59(41-37-51)64(58-26-18-17-19-27-58)60-42-38-57(63)39-43-60/h17-20,23-50,53-59H,3-16,21-22,51-52H2,1-2H3,(H,84,85);17-22,25-52,55-60H,3-16,23-24,53-54H2,1-2H3;19-42,45-49H,3-18,43-44H2,1-2H3;17-19,22-43,46-50H,3-16,20-21,44-45H2,1-2H3/b36-33+,37-34+,38-35+;40-37+,41-38+,42-39+;28-25+,29-26+,30-27+;33-30+,34-31+,35-32+
InChIKeyOZASCVROQSQZDL-UQCNKGEXSA-N
XLogP85.59
TPSA137.34 Ų
H-Bond Donors1
H-Bond Acceptors15
Rotatable Bonds117
Heavy Atoms304
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004216.33
LogP ≤ 585.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid with MolForge

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Related Compounds

2-[1-(4-Bromobenzoyl)-5-[2-[1-(4-bromobenzoyl)-6-fluoro-5-hydroxy-2-methylindol-3-yl]-3-methylpentanoyl]oxy-6-fluoro-2-methylindol-3-yl]acetic acid
CID 69485620
2-[1-(4-Bromobenzoyl)-5-[2-[1-(4-bromobenzoyl)-6-fluoro-5-hydroxy-2-methylindol-3-yl]pentanoyloxy]-6-fluoro-2-methylindol-3-yl]acetic acid
CID 69570021
2-[1-(4-Bromobenzoyl)-5-[2-[1-(4-bromobenzoyl)-6-fluoro-5-hydroxy-2-methylindol-3-yl]-3-methylbutanoyl]oxy-6-fluoro-2-methylindol-3-yl]acetic acid
CID 69571481
2-[1-(4-Bromobenzoyl)-5-[2-[1-(4-bromobenzoyl)-6-fluoro-5-hydroxy-2-methylindol-3-yl]propanoyloxy]-6-fluoro-2-methylindol-3-yl]acetic acid
CID 91107147
1-[[3-(Cyclopropylmethoxy)phenyl]methyl]-3-(3-methoxyphenyl)indole-2-carboxylic acid;1-[[3-(cyclopropylmethoxy)phenyl]methyl]-3-(3-methylphenyl)indole-2-carboxylic acid;1-[[3-(cyclopropylmethoxy)phenyl]methyl]-3-(3-propan-2-ylphenyl)indole-2-carboxylic acid;3-[3-(cyclopropylmethoxy)phenyl]-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid
CID 161282448
9-[4-(1-Benzofuran-2-yl)phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 68112249
3,6-Bis(9-phenylcarbazol-3-yl)-9-[4-(5-phenylfuran-2-yl)phenyl]carbazole
CID 68112258
9-Phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[4-(5-phenylfuran-2-yl)phenyl]carbazol-3-yl]carbazole
CID 68112261
(E)-3-[5-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]furan-2-yl]-2-cyanoprop-2-enoic acid
CID 68244562
2-[1-(4-Bromobenzoyl)-6-fluoro-5-methoxy-2-methylindol-3-yl]acetic acid;2-[1-(4-bromobenzoyl)-6-fluoro-5-methoxy-2-methylindol-3-yl]-3-methylpentanoic acid
CID 69569602
2-[1-(4-Bromobenzoyl)-5-[2-[1-(4-bromobenzoyl)-5-hydroxy-2-methylindol-3-yl]-3,3-dimethylbutanoyl]oxy-2-methylindol-3-yl]acetic acid
CID 69569611
2-[1-(4-Bromobenzoyl)-5-[2-[1-(4-bromobenzoyl)-5-hydroxy-2-methylindol-3-yl]-3-methylpentanoyl]oxy-2-methylindol-3-yl]acetic acid
CID 69570137

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid?
The IUPAC name of 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid (CID 163856856) is 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid.
What is the SMILES notation for 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid?
The canonical SMILES for 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid is CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3ccc(N(c4ccc(Br)cc4)c4ccc(Br)cc4)cc3)cc(/C=C/c3cccc(OCCCCCCCCCC)c3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccc(Br)cc4)cc3)cc(/C=C/c3cccc(OCCCCCCCCCC)c3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3cccc(OCCCCCCCCCC)c3)cc(/C=C/c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-n5c6ccccc6c6cc(C(=O)O)ccc65)cc4)cc3)c2)c1.CCCCCCCCCCOc1cccc(/C=C/c2cc(/C=C/c3cccc(OCCCCCCCCCC)c3)cc(/C=C/c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c2)c1.
What is the InChIKey of 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid?
The InChIKey is OZASCVROQSQZDL-UQCNKGEXSA-N. The full InChI is InChI=1S/C81H82N2O4.C80H82N2O2.C62H71Br2NO2.C62H72BrNO2/c1-3-5-7-9-11-13-15-21-51-86-71-27-23-25-60(56-71)33-36-63-53-64(37-34-61-26-24-28-72(57-61)87-52-22-16-14-12-10-8-6-4-2)55-65(54-63)38-35-62-39-49-79-75(58-62)73-29-17-19-31-77(73)82(79)69-45-40-66(41-46-69)67-42-47-70(48-43-67)83-78-32-20-18-30-74(78)76-59-68(81(84)85)44-50-80(76)83;1-3-5-7-9-11-13-15-23-53-83-71-29-25-27-61(58-71)37-40-64-55-65(41-38-62-28-26-30-72(59-62)84-54-24-16-14-12-10-8-6-4-2)57-66(56-64)42-39-63-43-52-80-76(60-63)75-33-19-22-36-79(75)82(80)70-50-46-68(47-51-70)67-44-48-69(49-45-67)81-77-34-20-17-31-73(77)74-32-18-21-35-78(74)81;1-3-5-7-9-11-13-15-17-43-66-61-23-19-21-51(48-61)26-29-54-45-53(46-55(47-54)30-27-52-22-20-24-62(49-52)67-44-18-16-14-12-10-8-6-4-2)28-25-50-31-37-58(38-32-50)65(59-39-33-56(63)34-40-59)60-41-35-57(64)36-42-60;1-3-5-7-9-11-13-15-20-44-65-61-28-22-24-52(49-61)31-34-55-46-54(47-56(48-55)35-32-53-25-23-29-62(50-53)66-45-21-16-14-12-10-8-6-4-2)33-30-51-36-40-59(41-37-51)64(58-26-18-17-19-27-58)60-42-38-57(63)39-43-60/h17-20,23-50,53-59H,3-16,21-22,51-52H2,1-2H3,(H,84,85);17-22,25-52,55-60H,3-16,23-24,53-54H2,1-2H3;19-42,45-49H,3-18,43-44H2,1-2H3;17-19,22-43,46-50H,3-16,20-21,44-45H2,1-2H3/b36-33+,37-34+,38-35+;40-37+,41-38+,42-39+;28-25+,29-26+,30-27+;33-30+,34-31+,35-32+.
What are the key properties of 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid?
4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid has a molecular weight of 4216.33 g/mol, XLogP of 85.59, 117 rotatable bonds, 1 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N,N-bis(4-bromophenyl)aniline;4-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-N-(4-bromophenyl)-N-phenylaniline;3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]-9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[4-[4-[3-[(E)-2-[3,5-bis[(E)-2-(3-decoxyphenyl)ethenyl]phenyl]ethenyl]carbazol-9-yl]phenyl]phenyl]carbazole-3-carboxylic acid is sourced from PubChem (CID 163856856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).