4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine

C282H206N10O8 — CID 159901284

IUPAC4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine
SMILESCC(C)c1cc(N(c2ccc(-c3ccccc3)cc2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4ccc(-c5ccccc5)cc4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.CC(C)c1cc(N(c2cccc(-c3ccccc3)c2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4cccc(-c5ccccc5)c4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.CC(C)c1cc(N(c2ccccc2-c2ccccc2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4ccccc4-c4ccccc4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.[C-]#[N+]c1ccc(N(c2cc(C(C)C)c3ccc4c(N(c5ccc(C#N)cc5-c5ccccc5)c5cccc6c5oc5ccccc56)cc(C(C)C)c5ccc2c3c54)c2cccc3c2oc2ccccc23)c(-c2ccccc2)c1
InChIInChI=1S/C72H50N4O2.3C70H52N2O2/c1-43(2)57-40-65(75(61-36-30-45(42-73)38-59(61)46-18-8-6-9-19-46)63-26-16-24-53-49-22-12-14-28-67(49)77-71(53)63)55-34-32-52-58(44(3)4)41-66(56-35-33-51(57)69(55)70(52)56)76(62-37-31-48(74-5)39-60(62)47-20-10-7-11-21-47)64-27-17-25-54-50-23-13-15-29-68(50)78-72(54)64;1-43(2)57-41-63(71(59-31-15-11-25-47(59)45-21-7-5-8-22-45)61-33-19-29-53-49-27-13-17-35-65(49)73-69(53)61)55-40-38-52-58(44(3)4)42-64(56-39-37-51(57)67(55)68(52)56)72(60-32-16-12-26-48(60)46-23-9-6-10-24-46)62-34-20-30-54-50-28-14-18-36-66(50)74-70(54)62;1-43(2)59-41-63(71(49-25-15-23-47(39-49)45-19-7-5-8-20-45)61-31-17-29-55-51-27-11-13-33-65(51)73-69(55)61)57-38-36-54-60(44(3)4)42-64(58-37-35-53(59)67(57)68(54)58)72(50-26-16-24-48(40-50)46-21-9-6-10-22-46)62-32-18-30-56-52-28-12-14-34-66(52)74-70(56)62;1-43(2)59-41-63(71(49-33-29-47(30-34-49)45-17-7-5-8-18-45)61-25-15-23-55-51-21-11-13-27-65(51)73-69(55)61)57-40-38-54-60(44(3)4)42-64(58-39-37-53(59)67(57)68(54)58)72(50-35-31-48(32-36-50)46-19-9-6-10-20-46)62-26-16-24-56-52-22-12-14-28-66(52)74-70(56)62/h6-41,43-44H,1-4H3;3*5-44H,1-4H3
InChIKeyNVZJLAGKAMLIHA-UHFFFAOYSA-N
MW3862.81 g/mol
LogP84.04
Rot. Bonds40

About 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine

4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine (PubChem CID 159901284) has the molecular formula C282H206N10O8 and a molecular weight of 3862.81 g/mol. Its IUPAC name is 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine.

Molecular Properties

Compound Name4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine
PubChem CID159901284
Molecular FormulaC282H206N10O8
Molecular Weight3862.81 g/mol
Exact Mass3859.60
IUPAC Name4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine
SMILESCC(C)c1cc(N(c2ccc(-c3ccccc3)cc2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4ccc(-c5ccccc5)cc4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.CC(C)c1cc(N(c2cccc(-c3ccccc3)c2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4cccc(-c5ccccc5)c4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.CC(C)c1cc(N(c2ccccc2-c2ccccc2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4ccccc4-c4ccccc4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.[C-]#[N+]c1ccc(N(c2cc(C(C)C)c3ccc4c(N(c5ccc(C#N)cc5-c5ccccc5)c5cccc6c5oc5ccccc56)cc(C(C)C)c5ccc2c3c54)c2cccc3c2oc2ccccc23)c(-c2ccccc2)c1
InChIInChI=1S/C72H50N4O2.3C70H52N2O2/c1-43(2)57-40-65(75(61-36-30-45(42-73)38-59(61)46-18-8-6-9-19-46)63-26-16-24-53-49-22-12-14-28-67(49)77-71(53)63)55-34-32-52-58(44(3)4)41-66(56-35-33-51(57)69(55)70(52)56)76(62-37-31-48(74-5)39-60(62)47-20-10-7-11-21-47)64-27-17-25-54-50-23-13-15-29-68(50)78-72(54)64;1-43(2)57-41-63(71(59-31-15-11-25-47(59)45-21-7-5-8-22-45)61-33-19-29-53-49-27-13-17-35-65(49)73-69(53)61)55-40-38-52-58(44(3)4)42-64(56-39-37-51(57)67(55)68(52)56)72(60-32-16-12-26-48(60)46-23-9-6-10-24-46)62-34-20-30-54-50-28-14-18-36-66(50)74-70(54)62;1-43(2)59-41-63(71(49-25-15-23-47(39-49)45-19-7-5-8-20-45)61-31-17-29-55-51-27-11-13-33-65(51)73-69(55)61)57-38-36-54-60(44(3)4)42-64(58-37-35-53(59)67(57)68(54)58)72(50-26-16-24-48(40-50)46-21-9-6-10-22-46)62-32-18-30-56-52-28-12-14-34-66(52)74-70(56)62;1-43(2)59-41-63(71(49-33-29-47(30-34-49)45-17-7-5-8-18-45)61-25-15-23-55-51-21-11-13-27-65(51)73-69(55)61)57-40-38-54-60(44(3)4)42-64(58-39-37-53(59)67(57)68(54)58)72(50-35-31-48(32-36-50)46-19-9-6-10-20-46)62-26-16-24-56-52-22-12-14-28-66(52)74-70(56)62/h6-41,43-44H,1-4H3;3*5-44H,1-4H3
InChIKeyNVZJLAGKAMLIHA-UHFFFAOYSA-N
XLogP84.04
TPSA159.19 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds40
Heavy Atoms300
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003862.81
LogP ≤ 584.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine with MolForge

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Related Compounds

4-[[6-(4-cyano-N-dibenzofuran-4-ylanilino)-3,8-di(propan-2-yl)pyren-1-yl]-dibenzofuran-4-ylamino]benzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-propan-2-ylphenyl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-diphenylpyrene-1,6-diamine
CID 159445590
4-[[6-[4-cyano-N-dibenzofuran-4-yl-2-(4-triphenylsilylphenyl)anilino]-3,8-di(propan-2-yl)pyren-1-yl]-dibenzofuran-4-ylamino]-3-(4-triphenylsilylphenyl)benzonitrile
CID 155620029
3-[[6-(3-cyano-N-dibenzofuran-4-yl-5-phenylanilino)pyren-1-yl]-dibenzofuran-4-ylamino]-5-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-dinaphthalen-1-yl-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 163744658
1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-1-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzothiophen-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;4-(N-[6-(N-(4-isocyanophenyl)-4-methylanilino)-3,8-di(propan-2-yl)pyren-1-yl]-4-trimethylsilylanilino)benzonitrile
CID 158659673
4-[[6-[4-cyano-N-dibenzofuran-4-yl-2-(4-triphenylsilylphenyl)anilino]-3,8-di(propan-2-yl)pyren-1-yl]-dibenzofuran-4-ylamino]-3-(4-triphenylsilylphenyl)benzonitrile;2-[dibenzofuran-4-yl-[6-[N-dibenzofuran-4-yl-2-isocyano-6-(4-triphenylsilylphenyl)anilino]-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-(4-triphenylsilylphenyl)benzonitrile
CID 158313975
4-[[6-(4-cyano-N-dibenzofuran-4-ylanilino)-3,8-di(propan-2-yl)pyren-1-yl]-dibenzofuran-4-ylamino]benzonitrile;3-[[6-(3-cyano-N-dibenzofuran-4-yl-5-phenylanilino)pyren-1-yl]-dibenzofuran-4-ylamino]-5-phenylbenzonitrile;3,8-dicyclopropyl-1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-diphenylpyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-dinaphthalen-1-yl-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 164963096
1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-4,9-di(propan-2-yl)pyrene-1,6-diamine
CID 164977006
4-[dibenzofuran-4-yl-[15-(N-dibenzofuran-4-yl-4-isocyanoanilino)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]amino]benzonitrile;9-N,15-N-di(dibenzofuran-4-yl)-9-N,15-N-bis(2,4-diphenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,15-diamine;9-N,15-N-di(dibenzofuran-4-yl)-9-N,15-N-bis(3,5-diphenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,15-diamine;9-N,15-N-di(dibenzofuran-4-yl)-9-N,15-N-bis(2-fluoro-4,6-diphenylphenyl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene-9,15-diamine
CID 158506580
1-N,6-N-bis(3-dibenzofuran-4-ylphenyl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 58461954
4-[[6-(4-cyano-N-dibenzofuran-4-ylanilino)-3,8-diphenylpyren-1-yl]-dibenzofuran-4-ylamino]benzonitrile
CID 166788491
N-[4-[4-(N-dibenzofuran-4-yl-4-phenylanilino)-3-phenylphenyl]phenyl]-N-phenyldibenzofuran-4-amine
CID 146582246
1-N,5-N-di(dibenzofuran-4-yl)-1-N,5-N-bis(2-methyl-5-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,5-diamine
CID 165097667

Frequently Asked Questions

What is the IUPAC name of 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine?
The IUPAC name of 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine (CID 159901284) is 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine.
What is the SMILES notation for 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine?
The canonical SMILES for 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine is CC(C)c1cc(N(c2ccc(-c3ccccc3)cc2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4ccc(-c5ccccc5)cc4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.CC(C)c1cc(N(c2cccc(-c3ccccc3)c2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4cccc(-c5ccccc5)c4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.CC(C)c1cc(N(c2ccccc2-c2ccccc2)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4ccccc4-c4ccccc4)c4cccc5c4oc4ccccc45)c4ccc1c2c34.[C-]#[N+]c1ccc(N(c2cc(C(C)C)c3ccc4c(N(c5ccc(C#N)cc5-c5ccccc5)c5cccc6c5oc5ccccc56)cc(C(C)C)c5ccc2c3c54)c2cccc3c2oc2ccccc23)c(-c2ccccc2)c1.
What is the InChIKey of 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine?
The InChIKey is NVZJLAGKAMLIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H50N4O2.3C70H52N2O2/c1-43(2)57-40-65(75(61-36-30-45(42-73)38-59(61)46-18-8-6-9-19-46)63-26-16-24-53-49-22-12-14-28-67(49)77-71(53)63)55-34-32-52-58(44(3)4)41-66(56-35-33-51(57)69(55)70(52)56)76(62-37-31-48(74-5)39-60(62)47-20-10-7-11-21-47)64-27-17-25-54-50-23-13-15-29-68(50)78-72(54)64;1-43(2)57-41-63(71(59-31-15-11-25-47(59)45-21-7-5-8-22-45)61-33-19-29-53-49-27-13-17-35-65(49)73-69(53)61)55-40-38-52-58(44(3)4)42-64(56-39-37-51(57)67(55)68(52)56)72(60-32-16-12-26-48(60)46-23-9-6-10-24-46)62-34-20-30-54-50-28-14-18-36-66(50)74-70(54)62;1-43(2)59-41-63(71(49-25-15-23-47(39-49)45-19-7-5-8-20-45)61-31-17-29-55-51-27-11-13-33-65(51)73-69(55)61)57-38-36-54-60(44(3)4)42-64(58-37-35-53(59)67(57)68(54)58)72(50-26-16-24-48(40-50)46-21-9-6-10-22-46)62-32-18-30-56-52-28-12-14-34-66(52)74-70(56)62;1-43(2)59-41-63(71(49-33-29-47(30-34-49)45-17-7-5-8-18-45)61-25-15-23-55-51-21-11-13-27-65(51)73-69(55)61)57-40-38-54-60(44(3)4)42-64(58-39-37-53(59)67(57)68(54)58)72(50-35-31-48(32-36-50)46-19-9-6-10-20-46)62-26-16-24-56-52-22-12-14-28-66(52)74-70(56)62/h6-41,43-44H,1-4H3;3*5-44H,1-4H3.
What are the key properties of 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine?
4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine has a molecular weight of 3862.81 g/mol, XLogP of 84.04, 40 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dibenzofuran-4-yl-[6-(N-dibenzofuran-4-yl-4-isocyano-2-phenylanilino)-3,8-di(propan-2-yl)pyren-1-yl]amino]-3-phenylbenzonitrile;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(3-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine is sourced from PubChem (CID 159901284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).