ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine

C222H230N28O2S7 — CID 159232836

IUPACethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine
SMILESC(=N/c1ccccc1)\c1cc(/C=N/c2ccccc2)c2cccccc1-2.C(=N/c1ccccc1)\c1ccc(-c2ccc(-c3ccc(/C=N/c4ccccc4)s3)c3nccnc23)s1.CC.CC.CC.CC.CC.CC.CCCCCCC.CCCCCCC.CCCCCCc1cc(/C=N/c2ccccc2)sc1-c1cc(-c2sc(/C=N/c3ccccc3)cc2CCCCCC)c2cccccc1-2.Cc1ccc(/C=N/c2ccc(-c3nnc(-c4ccc(/N=C/c5ccc(C)cc5)cc4)o3)cc2)cc1.Cc1ccc(/C=N/c2ccc(-c3nnc(-c4ccc(/N=C/c5ccc(C)s5)cc4)o3)cc2)s1.Cc1ccc(/N=C/c2ccc(/C=N/c3ccc(C)cn3)c3nccnc23)nc1.Cc1ccc(/N=C/c2ccc(/C=N/c3ccc(C)cn3)c3nsnc23)nc1
InChIInChI=1S/C44H46N2S2.C30H24N4O.C30H20N4S2.C26H20N4OS2.C24H18N2.C22H18N6.C20H16N6S.2C7H16.6C2H6/c1-3-5-7-12-20-33-28-37(31-45-35-22-14-9-15-23-35)47-43(33)41-30-42(40-27-19-11-18-26-39(40)41)44-34(21-13-8-6-4-2)29-38(48-44)32-46-36-24-16-10-17-25-36;1-21-3-7-23(8-4-21)19-31-27-15-11-25(12-16-27)29-33-34-30(35-29)26-13-17-28(18-14-26)32-20-24-9-5-22(2)6-10-24;1-3-7-21(8-4-1)33-19-23-11-15-27(35-23)25-13-14-26(30-29(25)31-17-18-32-30)28-16-12-24(36-28)20-34-22-9-5-2-6-10-22;1-17-3-13-23(32-17)15-27-21-9-5-19(6-10-21)25-29-30-26(31-25)20-7-11-22(12-8-20)28-16-24-14-4-18(2)33-24;1-4-10-21(11-5-1)25-17-19-16-20(18-26-22-12-6-2-7-13-22)24-15-9-3-8-14-23(19)24;1-15-3-7-19(25-11-15)27-13-17-5-6-18(22-21(17)23-9-10-24-22)14-28-20-8-4-16(2)12-26-20;1-13-3-7-17(21-9-13)23-11-15-5-6-16(20-19(15)25-27-26-20)12-24-18-8-4-14(2)10-22-18;2*1-3-5-7-6-4-2;6*1-2/h9-11,14-19,22-32H,3-8,12-13,20-21H2,1-2H3;3-20H,1-2H3;1-20H;3-16H,1-2H3;1-18H;3-14H,1-2H3;3-12H,1-2H3;2*3-7H2,1-2H3;6*1-2H3/b45-31+,46-32+;31-19+,32-20+;33-19+,34-20+;27-15+,28-16+;25-17+,26-18+;27-13+,28-14+;23-11+,24-12+;;;;;;;;
InChIKeyKTCRZXXJKRQKGR-JYEIZQJNSA-N
MW3546.94 g/mol
LogP65.29
Rot. Bonds54

About ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine

ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine (PubChem CID 159232836) has the molecular formula C222H230N28O2S7 and a molecular weight of 3546.94 g/mol. Its IUPAC name is ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine.

Molecular Properties

Compound Nameethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine
PubChem CID159232836
Molecular FormulaC222H230N28O2S7
Molecular Weight3546.94 g/mol
Exact Mass3543.68
IUPAC Nameethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine
SMILESC(=N/c1ccccc1)\c1cc(/C=N/c2ccccc2)c2cccccc1-2.C(=N/c1ccccc1)\c1ccc(-c2ccc(-c3ccc(/C=N/c4ccccc4)s3)c3nccnc23)s1.CC.CC.CC.CC.CC.CC.CCCCCCC.CCCCCCC.CCCCCCc1cc(/C=N/c2ccccc2)sc1-c1cc(-c2sc(/C=N/c3ccccc3)cc2CCCCCC)c2cccccc1-2.Cc1ccc(/C=N/c2ccc(-c3nnc(-c4ccc(/N=C/c5ccc(C)cc5)cc4)o3)cc2)cc1.Cc1ccc(/C=N/c2ccc(-c3nnc(-c4ccc(/N=C/c5ccc(C)s5)cc4)o3)cc2)s1.Cc1ccc(/N=C/c2ccc(/C=N/c3ccc(C)cn3)c3nccnc23)nc1.Cc1ccc(/N=C/c2ccc(/C=N/c3ccc(C)cn3)c3nsnc23)nc1
InChIInChI=1S/C44H46N2S2.C30H24N4O.C30H20N4S2.C26H20N4OS2.C24H18N2.C22H18N6.C20H16N6S.2C7H16.6C2H6/c1-3-5-7-12-20-33-28-37(31-45-35-22-14-9-15-23-35)47-43(33)41-30-42(40-27-19-11-18-26-39(40)41)44-34(21-13-8-6-4-2)29-38(48-44)32-46-36-24-16-10-17-25-36;1-21-3-7-23(8-4-21)19-31-27-15-11-25(12-16-27)29-33-34-30(35-29)26-13-17-28(18-14-26)32-20-24-9-5-22(2)6-10-24;1-3-7-21(8-4-1)33-19-23-11-15-27(35-23)25-13-14-26(30-29(25)31-17-18-32-30)28-16-12-24(36-28)20-34-22-9-5-2-6-10-22;1-17-3-13-23(32-17)15-27-21-9-5-19(6-10-21)25-29-30-26(31-25)20-7-11-22(12-8-20)28-16-24-14-4-18(2)33-24;1-4-10-21(11-5-1)25-17-19-16-20(18-26-22-12-6-2-7-13-22)24-15-9-3-8-14-23(19)24;1-15-3-7-19(25-11-15)27-13-17-5-6-18(22-21(17)23-9-10-24-22)14-28-20-8-4-16(2)12-26-20;1-13-3-7-17(21-9-13)23-11-15-5-6-16(20-19(15)25-27-26-20)12-24-18-8-4-14(2)10-22-18;2*1-3-5-7-6-4-2;6*1-2/h9-11,14-19,22-32H,3-8,12-13,20-21H2,1-2H3;3-20H,1-2H3;1-20H;3-16H,1-2H3;1-18H;3-14H,1-2H3;3-12H,1-2H3;2*3-7H2,1-2H3;6*1-2H3/b45-31+,46-32+;31-19+,32-20+;33-19+,34-20+;27-15+,28-16+;25-17+,26-18+;27-13+,28-14+;23-11+,24-12+;;;;;;;;
InChIKeyKTCRZXXJKRQKGR-JYEIZQJNSA-N
XLogP65.29
TPSA379.78 Ų
H-Bond Donors
H-Bond Acceptors37
Rotatable Bonds54
Heavy Atoms259
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003546.94
LogP ≤ 565.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine with MolForge

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Frequently Asked Questions

What is the IUPAC name of ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine?
The IUPAC name of ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine (CID 159232836) is ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine.
What is the SMILES notation for ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine?
The canonical SMILES for ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine is C(=N/c1ccccc1)\c1cc(/C=N/c2ccccc2)c2cccccc1-2.C(=N/c1ccccc1)\c1ccc(-c2ccc(-c3ccc(/C=N/c4ccccc4)s3)c3nccnc23)s1.CC.CC.CC.CC.CC.CC.CCCCCCC.CCCCCCC.CCCCCCc1cc(/C=N/c2ccccc2)sc1-c1cc(-c2sc(/C=N/c3ccccc3)cc2CCCCCC)c2cccccc1-2.Cc1ccc(/C=N/c2ccc(-c3nnc(-c4ccc(/N=C/c5ccc(C)cc5)cc4)o3)cc2)cc1.Cc1ccc(/C=N/c2ccc(-c3nnc(-c4ccc(/N=C/c5ccc(C)s5)cc4)o3)cc2)s1.Cc1ccc(/N=C/c2ccc(/C=N/c3ccc(C)cn3)c3nccnc23)nc1.Cc1ccc(/N=C/c2ccc(/C=N/c3ccc(C)cn3)c3nsnc23)nc1.
What is the InChIKey of ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine?
The InChIKey is KTCRZXXJKRQKGR-JYEIZQJNSA-N. The full InChI is InChI=1S/C44H46N2S2.C30H24N4O.C30H20N4S2.C26H20N4OS2.C24H18N2.C22H18N6.C20H16N6S.2C7H16.6C2H6/c1-3-5-7-12-20-33-28-37(31-45-35-22-14-9-15-23-35)47-43(33)41-30-42(40-27-19-11-18-26-39(40)41)44-34(21-13-8-6-4-2)29-38(48-44)32-46-36-24-16-10-17-25-36;1-21-3-7-23(8-4-21)19-31-27-15-11-25(12-16-27)29-33-34-30(35-29)26-13-17-28(18-14-26)32-20-24-9-5-22(2)6-10-24;1-3-7-21(8-4-1)33-19-23-11-15-27(35-23)25-13-14-26(30-29(25)31-17-18-32-30)28-16-12-24(36-28)20-34-22-9-5-2-6-10-22;1-17-3-13-23(32-17)15-27-21-9-5-19(6-10-21)25-29-30-26(31-25)20-7-11-22(12-8-20)28-16-24-14-4-18(2)33-24;1-4-10-21(11-5-1)25-17-19-16-20(18-26-22-12-6-2-7-13-22)24-15-9-3-8-14-23(19)24;1-15-3-7-19(25-11-15)27-13-17-5-6-18(22-21(17)23-9-10-24-22)14-28-20-8-4-16(2)12-26-20;1-13-3-7-17(21-9-13)23-11-15-5-6-16(20-19(15)25-27-26-20)12-24-18-8-4-14(2)10-22-18;2*1-3-5-7-6-4-2;6*1-2/h9-11,14-19,22-32H,3-8,12-13,20-21H2,1-2H3;3-20H,1-2H3;1-20H;3-16H,1-2H3;1-18H;3-14H,1-2H3;3-12H,1-2H3;2*3-7H2,1-2H3;6*1-2H3/b45-31+,46-32+;31-19+,32-20+;33-19+,34-20+;27-15+,28-16+;25-17+,26-18+;27-13+,28-14+;23-11+,24-12+;;;;;;;;.
What are the key properties of ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine?
ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine has a molecular weight of 3546.94 g/mol, XLogP of 65.29, 54 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;bis(heptane);1-[4-hexyl-5-[3-[3-hexyl-5-(phenyliminomethyl)thiophen-2-yl]azulen-1-yl]thiophen-2-yl]-N-phenylmethanimine;1-(4-methylphenyl)-N-[4-[5-[4-[(4-methylphenyl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-(5-methyl-2-pyridinyl)-1-[4-[(5-methyl-2-pyridinyl)iminomethyl]-2,1,3-benzothiadiazol-7-yl]methanimine;N-(5-methyl-2-pyridinyl)-1-[8-[(5-methyl-2-pyridinyl)iminomethyl]quinoxalin-5-yl]methanimine;1-(5-methylthiophen-2-yl)-N-[4-[5-[4-[(5-methylthiophen-2-yl)methylideneamino]phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methanimine;N-phenyl-1-[3-(phenyliminomethyl)azulen-1-yl]methanimine;N-phenyl-1-[5-[8-[5-(phenyliminomethyl)thiophen-2-yl]quinoxalin-5-yl]thiophen-2-yl]methanimine is sourced from PubChem (CID 159232836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).