benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline

C307H256N6S — CID 160605742

IUPACbenzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline
SMILESC1=CC(Nc2ccc(-c3ccc4ccccc4c3)cc2)CC(c2ccccc2)=C1c1ccccc1.C=C(/C=C\C1=CC(C)(C)c2ccccc21)N(C1=CCC(c2ccccc2)C=C1)c1ccc(-c2ccc(-c3cccc4c3C=CCC4)cc2)c(-c2ccccc2)c1.C=CC(C/C=C/N(c1ccc(-c2cccc3c2sc2ccccc23)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccccc1.CC1(C)C2=C(CCC(N(c3ccc(-c4cccc5ccccc45)cc3)C3C=CC(C4C=CC=CC4)=C(c4ccccc4)C3)=C2)c2ccccc21.CC1(C)c2ccccc2-c2ccc(N(C3=CCC(c4ccccc4)C=C3)c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)c(-c4ccccc4)c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)c(-c4ccccc4)c3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccccc21.c1ccccc1
InChIInChI=1S/C55H43N.C55H47N.C49H43N.C48H39N.C45H37NS.C34H27N.C15H14.C6H6/c1-55(2)53-20-12-11-19-50(53)51-34-32-48(37-54(51)55)56(46-29-27-40(28-30-46)38-13-5-3-6-14-38)47-31-33-49(52(36-47)42-16-7-4-8-17-42)43-24-21-41(22-25-43)45-26-23-39-15-9-10-18-44(39)35-45;1-39(25-26-46-38-55(2,3)54-24-13-12-22-52(46)54)56(47-33-31-41(32-34-47)40-15-6-4-7-16-40)48-35-36-51(53(37-48)43-17-8-5-9-18-43)45-29-27-44(28-30-45)50-23-14-20-42-19-10-11-21-49(42)50;1-49(2)47-23-12-11-21-44(47)45-31-29-40(33-48(45)49)50(38-26-24-37(25-27-38)42-22-13-19-35-18-9-10-20-41(35)42)39-28-30-43(34-14-5-3-6-15-34)46(32-39)36-16-7-4-8-17-36;1-47(2)43-21-13-11-19-38(43)40-27-24-35(30-45(40)47)49(36-25-28-41-39-20-12-14-22-44(39)48(3,4)46(41)31-36)34-23-26-37(32-15-7-5-8-16-32)42(29-34)33-17-9-6-10-18-33;1-4-31(32-14-6-5-7-15-32)16-13-29-46(35-27-28-38-37-17-8-10-21-41(37)45(2,3)42(38)30-35)34-25-23-33(24-26-34)36-19-12-20-40-39-18-9-11-22-43(39)47-44(36)40;1-3-10-27(11-4-1)33-22-21-32(24-34(33)28-12-5-2-6-13-28)35-31-19-17-26(18-20-31)30-16-15-25-9-7-8-14-29(25)23-30;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-2-4-6-5-3-1/h3-27,29-37,40H,28H2,1-2H3;4-9,11-18,20-31,33-38,41H,1,10,19,32H2,2-3H3;3-14,16-28,30,33-34,39H,15,29,31-32H2,1-2H3;5-31H,1-4H3;4-15,17-31H,1,16H2,2-3H3;1-23,32,35H,24H2;3-10H,1-2H3;1-6H/b;26-25-;;;29-13+;;;
InChIKeyREVRGTZEXUOXHI-ZROSDCSRSA-N
MW4061.53 g/mol
LogP82.77
Rot. Bonds40

About benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline

benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline (PubChem CID 160605742) has the molecular formula C307H256N6S and a molecular weight of 4061.53 g/mol. Its IUPAC name is benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline.

Molecular Properties

Compound Namebenzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline
PubChem CID160605742
Molecular FormulaC307H256N6S
Molecular Weight4061.53 g/mol
Exact Mass4057.99
IUPAC Namebenzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline
SMILESC1=CC(Nc2ccc(-c3ccc4ccccc4c3)cc2)CC(c2ccccc2)=C1c1ccccc1.C=C(/C=C\C1=CC(C)(C)c2ccccc21)N(C1=CCC(c2ccccc2)C=C1)c1ccc(-c2ccc(-c3cccc4c3C=CCC4)cc2)c(-c2ccccc2)c1.C=CC(C/C=C/N(c1ccc(-c2cccc3c2sc2ccccc23)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccccc1.CC1(C)C2=C(CCC(N(c3ccc(-c4cccc5ccccc45)cc3)C3C=CC(C4C=CC=CC4)=C(c4ccccc4)C3)=C2)c2ccccc21.CC1(C)c2ccccc2-c2ccc(N(C3=CCC(c4ccccc4)C=C3)c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)c(-c4ccccc4)c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)c(-c4ccccc4)c3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccccc21.c1ccccc1
InChIInChI=1S/C55H43N.C55H47N.C49H43N.C48H39N.C45H37NS.C34H27N.C15H14.C6H6/c1-55(2)53-20-12-11-19-50(53)51-34-32-48(37-54(51)55)56(46-29-27-40(28-30-46)38-13-5-3-6-14-38)47-31-33-49(52(36-47)42-16-7-4-8-17-42)43-24-21-41(22-25-43)45-26-23-39-15-9-10-18-44(39)35-45;1-39(25-26-46-38-55(2,3)54-24-13-12-22-52(46)54)56(47-33-31-41(32-34-47)40-15-6-4-7-16-40)48-35-36-51(53(37-48)43-17-8-5-9-18-43)45-29-27-44(28-30-45)50-23-14-20-42-19-10-11-21-49(42)50;1-49(2)47-23-12-11-21-44(47)45-31-29-40(33-48(45)49)50(38-26-24-37(25-27-38)42-22-13-19-35-18-9-10-20-41(35)42)39-28-30-43(34-14-5-3-6-15-34)46(32-39)36-16-7-4-8-17-36;1-47(2)43-21-13-11-19-38(43)40-27-24-35(30-45(40)47)49(36-25-28-41-39-20-12-14-22-44(39)48(3,4)46(41)31-36)34-23-26-37(32-15-7-5-8-16-32)42(29-34)33-17-9-6-10-18-33;1-4-31(32-14-6-5-7-15-32)16-13-29-46(35-27-28-38-37-17-8-10-21-41(37)45(2,3)42(38)30-35)34-25-23-33(24-26-34)36-19-12-20-40-39-18-9-11-22-43(39)47-44(36)40;1-3-10-27(11-4-1)33-22-21-32(24-34(33)28-12-5-2-6-13-28)35-31-19-17-26(18-20-31)30-16-15-25-9-7-8-14-29(25)23-30;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-2-4-6-5-3-1/h3-27,29-37,40H,28H2,1-2H3;4-9,11-18,20-31,33-38,41H,1,10,19,32H2,2-3H3;3-14,16-28,30,33-34,39H,15,29,31-32H2,1-2H3;5-31H,1-4H3;4-15,17-31H,1,16H2,2-3H3;1-23,32,35H,24H2;3-10H,1-2H3;1-6H/b;26-25-;;;29-13+;;;
InChIKeyREVRGTZEXUOXHI-ZROSDCSRSA-N
XLogP82.77
TPSA28.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds40
Heavy Atoms314
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004061.53
LogP ≤ 582.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline?
The IUPAC name of benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline (CID 160605742) is benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline.
What is the SMILES notation for benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline?
The canonical SMILES for benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline is C1=CC(Nc2ccc(-c3ccc4ccccc4c3)cc2)CC(c2ccccc2)=C1c1ccccc1.C=C(/C=C\C1=CC(C)(C)c2ccccc21)N(C1=CCC(c2ccccc2)C=C1)c1ccc(-c2ccc(-c3cccc4c3C=CCC4)cc2)c(-c2ccccc2)c1.C=CC(C/C=C/N(c1ccc(-c2cccc3c2sc2ccccc23)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccccc1.CC1(C)C2=C(CCC(N(c3ccc(-c4cccc5ccccc45)cc3)C3C=CC(C4C=CC=CC4)=C(c4ccccc4)C3)=C2)c2ccccc21.CC1(C)c2ccccc2-c2ccc(N(C3=CCC(c4ccccc4)C=C3)c3ccc(-c4ccc(-c5ccc6ccccc6c5)cc4)c(-c4ccccc4)c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)c(-c4ccccc4)c3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccccc21.c1ccccc1.
What is the InChIKey of benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline?
The InChIKey is REVRGTZEXUOXHI-ZROSDCSRSA-N. The full InChI is InChI=1S/C55H43N.C55H47N.C49H43N.C48H39N.C45H37NS.C34H27N.C15H14.C6H6/c1-55(2)53-20-12-11-19-50(53)51-34-32-48(37-54(51)55)56(46-29-27-40(28-30-46)38-13-5-3-6-14-38)47-31-33-49(52(36-47)42-16-7-4-8-17-42)43-24-21-41(22-25-43)45-26-23-39-15-9-10-18-44(39)35-45;1-39(25-26-46-38-55(2,3)54-24-13-12-22-52(46)54)56(47-33-31-41(32-34-47)40-15-6-4-7-16-40)48-35-36-51(53(37-48)43-17-8-5-9-18-43)45-29-27-44(28-30-45)50-23-14-20-42-19-10-11-21-49(42)50;1-49(2)47-23-12-11-21-44(47)45-31-29-40(33-48(45)49)50(38-26-24-37(25-27-38)42-22-13-19-35-18-9-10-20-41(35)42)39-28-30-43(34-14-5-3-6-15-34)46(32-39)36-16-7-4-8-17-36;1-47(2)43-21-13-11-19-38(43)40-27-24-35(30-45(40)47)49(36-25-28-41-39-20-12-14-22-44(39)48(3,4)46(41)31-36)34-23-26-37(32-15-7-5-8-16-32)42(29-34)33-17-9-6-10-18-33;1-4-31(32-14-6-5-7-15-32)16-13-29-46(35-27-28-38-37-17-8-10-21-41(37)45(2,3)42(38)30-35)34-25-23-33(24-26-34)36-19-12-20-40-39-18-9-11-22-43(39)47-44(36)40;1-3-10-27(11-4-1)33-22-21-32(24-34(33)28-12-5-2-6-13-28)35-31-19-17-26(18-20-31)30-16-15-25-9-7-8-14-29(25)23-30;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-2-4-6-5-3-1/h3-27,29-37,40H,28H2,1-2H3;4-9,11-18,20-31,33-38,41H,1,10,19,32H2,2-3H3;3-14,16-28,30,33-34,39H,15,29,31-32H2,1-2H3;5-31H,1-4H3;4-15,17-31H,1,16H2,2-3H3;1-23,32,35H,24H2;3-10H,1-2H3;1-6H/b;26-25-;;;29-13+;;;.
What are the key properties of benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline?
benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline has a molecular weight of 4061.53 g/mol, XLogP of 82.77, 40 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;N-(4-cyclohexa-2,4-dien-1-yl-5-phenylcyclohexa-2,4-dien-1-yl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-3,4-dihydrofluoren-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[(1E)-4-phenylhexa-1,5-dienyl]fluoren-2-amine;4-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-N-[(3Z)-4-(3,3-dimethylinden-1-yl)buta-1,3-dien-2-yl]-3-phenyl-N-(4-phenylcyclohexa-1,5-dien-1-yl)aniline;9,9-dimethylfluorene;N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)-3-phenylphenyl]-N-(4-phenylcyclohexa-1,5-dien-1-yl)fluoren-2-amine;N-(4,5-diphenylcyclohexa-2,4-dien-1-yl)-4-naphthalen-2-ylaniline is sourced from PubChem (CID 160605742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).