N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine

C194H122N4O6S2 — CID 161396501

IUPACN-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(C4(c5ccccc5)c5cccc6oc7cccc4c7c56)cc3)c3ccc4c(c3)oc3ccccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(C4(c5ccccc5)c5cccc6oc7cccc4c7c56)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc1.c1ccc(C2(c3ccc(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc5c(c4)oc4ccccc45)cc3)c3cccc4oc5cccc2c5c34)cc1.c1ccc(N(c2ccc(C3(c4ccccc4)c4cccc5oc6cccc3c6c45)cc2)c2ccc3c(c2)sc2ccccc23)cc1
InChIInChI=1S/C53H33NO2.C49H31NO2.C49H31NOS.C43H27NOS/c1-2-13-36(14-3-1)53(45-18-9-21-48-51(45)52-46(53)19-10-22-49(52)56-48)37-25-29-39(30-26-37)54(40-31-32-44-43-16-6-7-20-47(43)55-50(44)33-40)38-27-23-35(24-28-38)42-17-8-12-34-11-4-5-15-41(34)42;1-3-11-32(12-4-1)33-21-25-36(26-22-33)50(38-29-30-40-39-15-7-8-18-43(39)51-46(40)31-38)37-27-23-35(24-28-37)49(34-13-5-2-6-14-34)41-16-9-19-44-47(41)48-42(49)17-10-20-45(48)52-44;1-3-11-32(12-4-1)33-21-25-36(26-22-33)50(38-29-30-40-39-15-7-8-20-45(39)52-46(40)31-38)37-27-23-35(24-28-37)49(34-13-5-2-6-14-34)41-16-9-18-43-47(41)48-42(49)17-10-19-44(48)51-43;1-3-11-28(12-4-1)43(35-16-9-18-37-41(35)42-36(43)17-10-19-38(42)45-37)29-21-23-31(24-22-29)44(30-13-5-2-6-14-30)32-25-26-34-33-15-7-8-20-39(33)46-40(34)27-32/h1-33H;2*1-31H;1-27H
InChIKeyVTRATTSXDHPRLB-UHFFFAOYSA-N
MW2669.27 g/mol
LogP53.70
Rot. Bonds23

About N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine

N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine (PubChem CID 161396501) has the molecular formula C194H122N4O6S2 and a molecular weight of 2669.27 g/mol. Its IUPAC name is N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine.

Molecular Properties

Compound NameN-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine
PubChem CID161396501
Molecular FormulaC194H122N4O6S2
Molecular Weight2669.27 g/mol
Exact Mass2666.88
IUPAC NameN-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(C4(c5ccccc5)c5cccc6oc7cccc4c7c56)cc3)c3ccc4c(c3)oc3ccccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(C4(c5ccccc5)c5cccc6oc7cccc4c7c56)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc1.c1ccc(C2(c3ccc(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc5c(c4)oc4ccccc45)cc3)c3cccc4oc5cccc2c5c34)cc1.c1ccc(N(c2ccc(C3(c4ccccc4)c4cccc5oc6cccc3c6c45)cc2)c2ccc3c(c2)sc2ccccc23)cc1
InChIInChI=1S/C53H33NO2.C49H31NO2.C49H31NOS.C43H27NOS/c1-2-13-36(14-3-1)53(45-18-9-21-48-51(45)52-46(53)19-10-22-49(52)56-48)37-25-29-39(30-26-37)54(40-31-32-44-43-16-6-7-20-47(43)55-50(44)33-40)38-27-23-35(24-28-38)42-17-8-12-34-11-4-5-15-41(34)42;1-3-11-32(12-4-1)33-21-25-36(26-22-33)50(38-29-30-40-39-15-7-8-18-43(39)51-46(40)31-38)37-27-23-35(24-28-37)49(34-13-5-2-6-14-34)41-16-9-19-44-47(41)48-42(49)17-10-20-45(48)52-44;1-3-11-32(12-4-1)33-21-25-36(26-22-33)50(38-29-30-40-39-15-7-8-20-45(39)52-46(40)31-38)37-27-23-35(24-28-37)49(34-13-5-2-6-14-34)41-16-9-18-43-47(41)48-42(49)17-10-19-44(48)51-43;1-3-11-28(12-4-1)43(35-16-9-18-37-41(35)42-36(43)17-10-19-38(42)45-37)29-21-23-31(24-22-29)44(30-13-5-2-6-14-30)32-25-26-34-33-15-7-8-20-39(33)46-40(34)27-32/h1-33H;2*1-31H;1-27H
InChIKeyVTRATTSXDHPRLB-UHFFFAOYSA-N
XLogP53.70
TPSA91.80 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds23
Heavy Atoms206
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002669.27
LogP ≤ 553.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine with MolForge

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Related Compounds

2-N-dibenzofuran-3-yl-9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenylfluorene-2,7-diamine;2-N-dibenzothiophen-3-yl-9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-(4-phenylphenyl)fluorene-2,7-diamine;7-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine;9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;7-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine
CID 159611762
9-dibenzofuran-3-yl-N,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-(9-dibenzofuran-2-yl-9-phenylfluoren-2-yl)-N-(4-phenylphenyl)dibenzothiophen-3-amine;9-dibenzofuran-3-yl-N,N,9-triphenylfluoren-2-amine
CID 157052053
7-N-dibenzofuran-3-yl-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine;7-N-dibenzothiophen-3-yl-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-diphenyl-2-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;2-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-2-N,7-N-diphenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 157280557
N-dibenzofuran-3-yl-7-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 163987640
N-(4-naphthalen-1-ylphenyl)-N-[3-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[3-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-1-ylphenyl)-N-[3-(8-phenylnaphthalen-1-yl)phenyl]dibenzothiophen-3-amine
CID 160932479
N-[4-(4-phenylphenyl)phenyl]-N-[9-phenyl-9-(4-phenylphenyl)fluoren-2-yl]dibenzofuran-3-amine;7-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-[9-phenyl-9-(3-phenylphenyl)fluoren-2-yl]dibenzothiophen-3-amine;9-phenyl-9-(3-phenylphenyl)-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 163854265
7-N-dibenzofuran-3-yl-2-N,2-N,7-N-triphenyldibenzothiophene-2,7-diamine;7-N-dibenzothiophen-3-yl-2-N-(4-naphthalen-1-ylphenyl)-2-N-phenyl-7-N-(4-phenylphenyl)dibenzothiophene-2,7-diamine;7-N-dibenzothiophen-4-yl-2-N,2-N,7-N-triphenyldibenzothiophene-2,7-diamine
CID 167608369
N-dibenzothiophen-3-yl-N-[3-(3-naphthalen-1-ylphenyl)phenyl]dibenzofuran-3-amine
CID 168846117
N-(4-naphthalen-1-ylphenyl)-N-tetraphenylen-2-yldibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-tetraphenylen-2-yldibenzofuran-3-amine;N-[4-(9-phenylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)tetraphenylen-2-amine
CID 167566203
N,N-bis(4-naphthalen-1-ylphenyl)-4-phenylaniline;N-(4-naphthalen-1-ylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]dibenzofuran-3-amine;3-(9-phenylfluoren-9-yl)-N,N-bis(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline
CID 163659146
N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine
CID 129230912
N-(4-dibenzofuran-3-ylphenyl)-N-(4-dibenzothiophen-1-ylphenyl)-3-naphthalen-1-ylaniline
CID 167324053

Frequently Asked Questions

What is the IUPAC name of N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine?
The IUPAC name of N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine (CID 161396501) is N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine.
What is the SMILES notation for N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine?
The canonical SMILES for N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine is c1ccc(-c2ccc(N(c3ccc(C4(c5ccccc5)c5cccc6oc7cccc4c7c56)cc3)c3ccc4c(c3)oc3ccccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(C4(c5ccccc5)c5cccc6oc7cccc4c7c56)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc1.c1ccc(C2(c3ccc(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc5c(c4)oc4ccccc45)cc3)c3cccc4oc5cccc2c5c34)cc1.c1ccc(N(c2ccc(C3(c4ccccc4)c4cccc5oc6cccc3c6c45)cc2)c2ccc3c(c2)sc2ccccc23)cc1.
What is the InChIKey of N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine?
The InChIKey is VTRATTSXDHPRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H33NO2.C49H31NO2.C49H31NOS.C43H27NOS/c1-2-13-36(14-3-1)53(45-18-9-21-48-51(45)52-46(53)19-10-22-49(52)56-48)37-25-29-39(30-26-37)54(40-31-32-44-43-16-6-7-20-47(43)55-50(44)33-40)38-27-23-35(24-28-38)42-17-8-12-34-11-4-5-15-41(34)42;1-3-11-32(12-4-1)33-21-25-36(26-22-33)50(38-29-30-40-39-15-7-8-18-43(39)51-46(40)31-38)37-27-23-35(24-28-37)49(34-13-5-2-6-14-34)41-16-9-19-44-47(41)48-42(49)17-10-20-45(48)52-44;1-3-11-32(12-4-1)33-21-25-36(26-22-33)50(38-29-30-40-39-15-7-8-20-45(39)52-46(40)31-38)37-27-23-35(24-28-37)49(34-13-5-2-6-14-34)41-16-9-18-43-47(41)48-42(49)17-10-19-44(48)51-43;1-3-11-28(12-4-1)43(35-16-9-18-37-41(35)42-36(43)17-10-19-38(42)45-37)29-21-23-31(24-22-29)44(30-13-5-2-6-14-30)32-25-26-34-33-15-7-8-20-39(33)46-40(34)27-32/h1-33H;2*1-31H;1-27H.
What are the key properties of N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine?
N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine has a molecular weight of 2669.27 g/mol, XLogP of 53.70, 23 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-naphthalen-1-ylphenyl)-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzothiophen-3-amine is sourced from PubChem (CID 161396501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).