bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane

C208H304N24+8 — CID 159630348

IUPACbis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane
SMILESC.C.C.C.C.C.C.C.CC(C)CN(CC(C)C)c1ccc(N(c2ccc(N(CC(C)C)CC(C)C)cc2)c2ccc([N+](=C3C=CC(=[N+](CC(C)C)CC(C)C)C=C3)c3ccc(N(CC(C)C)CC(C)C)cc3)cc2)cc1.CCC(C)N(c1ccc(N(c2ccc(N(C(C)CC)C(C)CC)cc2)c2ccc([N+](=C3C=CC(=[N+](C(C)CC)C(C)CC)C=C3)c3ccc(N(C(C)CC)C(C)CC)cc3)cc2)cc1)C(C)CC.CCN(CC)c1ccc(N(c2ccc(N(CC)CC)cc2)c2ccc([N+](=C3C=CC(=[N+](CC)CC)C=C3)c3ccc(N(CC)CC)cc3)cc2)cc1.Nc1ccc([N+](=C2C=CC(=[N+](c3ccc(N)cc3)c3ccc(N)cc3)C=C2)c2ccc(N)cc2)cc1
InChIInChI=1S/2C62H92N6.C46H60N6.C30H27N6.8CH4/c1-45(2)37-63(38-46(3)4)53-17-25-57(26-18-53)67(58-27-19-54(20-28-58)64(39-47(5)6)40-48(7)8)61-33-35-62(36-34-61)68(59-29-21-55(22-30-59)65(41-49(9)10)42-50(11)12)60-31-23-56(24-32-60)66(43-51(13)14)44-52(15)16;1-17-45(9)63(46(10)18-2)53-25-33-57(34-26-53)67(58-35-27-54(28-36-58)64(47(11)19-3)48(12)20-4)61-41-43-62(44-42-61)68(59-37-29-55(30-38-59)65(49(13)21-5)50(14)22-6)60-39-31-56(32-40-60)66(51(15)23-7)52(16)24-8;1-9-47(10-2)37-17-25-41(26-18-37)51(42-27-19-38(20-28-42)48(11-3)12-4)45-33-35-46(36-34-45)52(43-29-21-39(22-30-43)49(13-5)14-6)44-31-23-40(24-32-44)50(15-7)16-8;31-21-1-9-25(10-2-21)35(26-11-3-22(32)4-12-26)29-17-19-30(20-18-29)36(27-13-5-23(33)6-14-27)28-15-7-24(34)8-16-28;;;;;;;;/h17-36,45-52H,37-44H2,1-16H3;25-52H,17-24H2,1-16H3;17-36H,9-16H2,1-8H3;1-20H,31-32H2,(H3,33,34);8*1H4/q3*+2;+1;;;;;;;;/p+1
InChIKeyAGOSBANWZRZRCM-UHFFFAOYSA-O
MW3140.89 g/mol
LogP53.57
Rot. Bonds68

About bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane

bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane (PubChem CID 159630348) has the molecular formula C208H304N24+8 and a molecular weight of 3140.89 g/mol. Its IUPAC name is bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane.

Molecular Properties

Compound Namebis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane
PubChem CID159630348
Molecular FormulaC208H304N24+8
Molecular Weight3140.89 g/mol
Exact Mass3138.45
IUPAC Namebis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane
SMILESC.C.C.C.C.C.C.C.CC(C)CN(CC(C)C)c1ccc(N(c2ccc(N(CC(C)C)CC(C)C)cc2)c2ccc([N+](=C3C=CC(=[N+](CC(C)C)CC(C)C)C=C3)c3ccc(N(CC(C)C)CC(C)C)cc3)cc2)cc1.CCC(C)N(c1ccc(N(c2ccc(N(C(C)CC)C(C)CC)cc2)c2ccc([N+](=C3C=CC(=[N+](C(C)CC)C(C)CC)C=C3)c3ccc(N(C(C)CC)C(C)CC)cc3)cc2)cc1)C(C)CC.CCN(CC)c1ccc(N(c2ccc(N(CC)CC)cc2)c2ccc([N+](=C3C=CC(=[N+](CC)CC)C=C3)c3ccc(N(CC)CC)cc3)cc2)cc1.Nc1ccc([N+](=C2C=CC(=[N+](c3ccc(N)cc3)c3ccc(N)cc3)C=C2)c2ccc(N)cc2)cc1
InChIInChI=1S/2C62H92N6.C46H60N6.C30H27N6.8CH4/c1-45(2)37-63(38-46(3)4)53-17-25-57(26-18-53)67(58-27-19-54(20-28-58)64(39-47(5)6)40-48(7)8)61-33-35-62(36-34-61)68(59-29-21-55(22-30-59)65(41-49(9)10)42-50(11)12)60-31-23-56(24-32-60)66(43-51(13)14)44-52(15)16;1-17-45(9)63(46(10)18-2)53-25-33-57(34-26-53)67(58-35-27-54(28-36-58)64(47(11)19-3)48(12)20-4)61-41-43-62(44-42-61)68(59-37-29-55(30-38-59)65(49(13)21-5)50(14)22-6)60-39-31-56(32-40-60)66(51(15)23-7)52(16)24-8;1-9-47(10-2)37-17-25-41(26-18-37)51(42-27-19-38(20-28-42)48(11-3)12-4)45-33-35-46(36-34-45)52(43-29-21-39(22-30-43)49(13-5)14-6)44-31-23-40(24-32-44)50(15-7)16-8;31-21-1-9-25(10-2-21)35(26-11-3-22(32)4-12-26)29-17-19-30(20-18-29)36(27-13-5-23(33)6-14-27)28-15-7-24(34)8-16-28;;;;;;;;/h17-36,45-52H,37-44H2,1-16H3;25-52H,17-24H2,1-16H3;17-36H,9-16H2,1-8H3;1-20H,31-32H2,(H3,33,34);8*1H4/q3*+2;+1;;;;;;;;/p+1
InChIKeyAGOSBANWZRZRCM-UHFFFAOYSA-O
XLogP53.57
TPSA167.04 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds68
Heavy Atoms232
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003140.89
LogP ≤ 553.57
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}, {'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'chinone_1', 'substructure': 'N/A'}

Analyze bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane with MolForge

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Related Compounds

bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;dibutyl-[4-[[4-[4-(dibutylamino)-N-[4-(dibutylamino)phenyl]anilino]phenyl]-[4-(dibutylamino)phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(dimethylamino)-N-[4-(dimethylamino)phenyl]anilino]phenyl]-[4-(dimethylamino)phenyl]-(4-dimethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;(4-diphenylazaniumylidenecyclohexa-2,5-dien-1-ylidene)-diphenylazanium
CID 164960945
[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)-(4-ethylphenyl)azanium
CID 59917943
[4-[4-[bis(2-methylpropyl)amino]-N-methylanilino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-methylazanium
CID 155634766
bis[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;bis(2,2,2-trifluoroacetate)
CID 88715193
4-N,4-N-diethylbenzene-1,4-diamine chloride
CID 18327270
bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium
CID 58862536
bis([4-[bis[4-(diethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-diethylazanium) dichloride
CID 160747743
1-N,1-N,4-N,4-N-tetraethylbenzene-1,4-diamine
CID 14438301
4-N-[4-[4-(4-amino-N-(4-aminophenyl)anilino)-N-[4-[4-(4-amino-N-(4-aminophenyl)anilino)-N-[4-(4-amino-N-(4-aminophenyl)anilino)phenyl]anilino]phenyl]anilino]phenyl]-4-N-(4-aminophenyl)benzene-1,4-diamine
CID 163509117
2-(4-amino-N-ethylanilino)ethanol;hydrate
CID 68828787
1-[4-[ethyl(2-methylpropyl)amino]phenyl]propan-1-ol
CID 114066768
2-ethoxy-4-N,4-N-bis(2-methylpropyl)benzene-1,4-diamine
CID 63670487

Frequently Asked Questions

What is the IUPAC name of bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane?
The IUPAC name of bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane (CID 159630348) is bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane.
What is the SMILES notation for bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane?
The canonical SMILES for bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane is C.C.C.C.C.C.C.C.CC(C)CN(CC(C)C)c1ccc(N(c2ccc(N(CC(C)C)CC(C)C)cc2)c2ccc([N+](=C3C=CC(=[N+](CC(C)C)CC(C)C)C=C3)c3ccc(N(CC(C)C)CC(C)C)cc3)cc2)cc1.CCC(C)N(c1ccc(N(c2ccc(N(C(C)CC)C(C)CC)cc2)c2ccc([N+](=C3C=CC(=[N+](C(C)CC)C(C)CC)C=C3)c3ccc(N(C(C)CC)C(C)CC)cc3)cc2)cc1)C(C)CC.CCN(CC)c1ccc(N(c2ccc(N(CC)CC)cc2)c2ccc([N+](=C3C=CC(=[N+](CC)CC)C=C3)c3ccc(N(CC)CC)cc3)cc2)cc1.Nc1ccc([N+](=C2C=CC(=[N+](c3ccc(N)cc3)c3ccc(N)cc3)C=C2)c2ccc(N)cc2)cc1.
What is the InChIKey of bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane?
The InChIKey is AGOSBANWZRZRCM-UHFFFAOYSA-O. The full InChI is InChI=1S/2C62H92N6.C46H60N6.C30H27N6.8CH4/c1-45(2)37-63(38-46(3)4)53-17-25-57(26-18-53)67(58-27-19-54(20-28-58)64(39-47(5)6)40-48(7)8)61-33-35-62(36-34-61)68(59-29-21-55(22-30-59)65(41-49(9)10)42-50(11)12)60-31-23-56(24-32-60)66(43-51(13)14)44-52(15)16;1-17-45(9)63(46(10)18-2)53-25-33-57(34-26-53)67(58-35-27-54(28-36-58)64(47(11)19-3)48(12)20-4)61-41-43-62(44-42-61)68(59-37-29-55(30-38-59)65(49(13)21-5)50(14)22-6)60-39-31-56(32-40-60)66(51(15)23-7)52(16)24-8;1-9-47(10-2)37-17-25-41(26-18-37)51(42-27-19-38(20-28-42)48(11-3)12-4)45-33-35-46(36-34-45)52(43-29-21-39(22-30-43)49(13-5)14-6)44-31-23-40(24-32-44)50(15-7)16-8;31-21-1-9-25(10-2-21)35(26-11-3-22(32)4-12-26)29-17-19-30(20-18-29)36(27-13-5-23(33)6-14-27)28-15-7-24(34)8-16-28;;;;;;;;/h17-36,45-52H,37-44H2,1-16H3;25-52H,17-24H2,1-16H3;17-36H,9-16H2,1-8H3;1-20H,31-32H2,(H3,33,34);8*1H4/q3*+2;+1;;;;;;;;/p+1.
What are the key properties of bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane?
bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane has a molecular weight of 3140.89 g/mol, XLogP of 53.57, 68 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-aminophenyl)-[4-bis(4-aminophenyl)azaniumylidenecyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-[bis(2-methylpropyl)amino]-N-[4-[bis(2-methylpropyl)amino]phenyl]anilino]phenyl]-[4-[bis(2-methylpropyl)amino]phenyl]-[4-[bis(2-methylpropyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;di(butan-2-yl)-[4-[[4-[4-[di(butan-2-yl)amino]-N-[4-[di(butan-2-yl)amino]phenyl]anilino]phenyl]-[4-[di(butan-2-yl)amino]phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium;[4-[4-(diethylamino)-N-[4-(diethylamino)phenyl]anilino]phenyl]-[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)azanium;methane is sourced from PubChem (CID 159630348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).