2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol

C203H160N10O10 — CID 160692486

IUPAC2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol
SMILESCOc1c(C(=C=Nc2ccccc2)c2ccccc2)c(CO)c(C(=C=Nc2ccccc2)c2ccccc2)c(OC)c1C(=C=Nc1ccccc1)c1ccccc1.COc1c(C(=C=Nc2ccccc2)c2ccccc2)cccc1-c1cccc(C(=C=Nc2ccccc2)c2ccccc2)c1CO.COc1cc(CO)c(C(=C=Nc2ccccc2)c2ccccc2)cc1C(=C=Nc1ccccc1)c1ccccc1.COc1ccc(C(C)(C)c2ccc(C(C)(c3ccc(OC)c(C(=C=Nc4ccccc4)c4ccccc4)c3)c3ccc(OC)c(C(=C=Nc4ccccc4)c4ccccc4)c3)cc2)cc1C(=C=Nc1ccccc1)c1ccccc1
InChIInChI=1S/C74H61N3O3.C51H39N3O3.C42H32N2O2.C36H28N2O2/c1-73(2,58-41-44-70(78-4)64(47-58)67(53-25-13-7-14-26-53)50-75-61-31-19-10-20-32-61)56-37-39-57(40-38-56)74(3,59-42-45-71(79-5)65(48-59)68(54-27-15-8-16-28-54)51-76-62-33-21-11-22-34-62)60-43-46-72(80-6)66(49-60)69(55-29-17-9-18-30-55)52-77-63-35-23-12-24-36-63;1-56-50-47(43(37-21-9-3-10-22-37)33-52-40-27-15-6-16-28-40)46(36-55)48(44(38-23-11-4-12-24-38)34-53-41-29-17-7-18-30-41)51(57-2)49(50)45(39-25-13-5-14-26-39)35-54-42-31-19-8-20-32-42;1-46-42-37(26-15-27-38(42)40(32-18-8-3-9-19-32)29-44-34-22-12-5-13-23-34)35-24-14-25-36(41(35)30-45)39(31-16-6-2-7-17-31)28-43-33-20-10-4-11-21-33;1-40-36-22-29(26-39)32(34(27-14-6-2-7-15-27)24-37-30-18-10-4-11-19-30)23-33(36)35(28-16-8-3-9-17-28)25-38-31-20-12-5-13-21-31/h7-49H,1-6H3;3-32,55H,36H2,1-2H3;2-27,45H,30H2,1H3;2-23,39H,26H2,1H3
InChIKeyRPOVRLUXWHXMCC-UHFFFAOYSA-N
MW2899.57 g/mol
LogP46.96
Rot. Bonds46

About 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol

2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol (PubChem CID 160692486) has the molecular formula C203H160N10O10 and a molecular weight of 2899.57 g/mol. Its IUPAC name is 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol.

Molecular Properties

Compound Name2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol
PubChem CID160692486
Molecular FormulaC203H160N10O10
Molecular Weight2899.57 g/mol
Exact Mass2897.23
IUPAC Name2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol
SMILESCOc1c(C(=C=Nc2ccccc2)c2ccccc2)c(CO)c(C(=C=Nc2ccccc2)c2ccccc2)c(OC)c1C(=C=Nc1ccccc1)c1ccccc1.COc1c(C(=C=Nc2ccccc2)c2ccccc2)cccc1-c1cccc(C(=C=Nc2ccccc2)c2ccccc2)c1CO.COc1cc(CO)c(C(=C=Nc2ccccc2)c2ccccc2)cc1C(=C=Nc1ccccc1)c1ccccc1.COc1ccc(C(C)(C)c2ccc(C(C)(c3ccc(OC)c(C(=C=Nc4ccccc4)c4ccccc4)c3)c3ccc(OC)c(C(=C=Nc4ccccc4)c4ccccc4)c3)cc2)cc1C(=C=Nc1ccccc1)c1ccccc1
InChIInChI=1S/C74H61N3O3.C51H39N3O3.C42H32N2O2.C36H28N2O2/c1-73(2,58-41-44-70(78-4)64(47-58)67(53-25-13-7-14-26-53)50-75-61-31-19-10-20-32-61)56-37-39-57(40-38-56)74(3,59-42-45-71(79-5)65(48-59)68(54-27-15-8-16-28-54)51-76-62-33-21-11-22-34-62)60-43-46-72(80-6)66(49-60)69(55-29-17-9-18-30-55)52-77-63-35-23-12-24-36-63;1-56-50-47(43(37-21-9-3-10-22-37)33-52-40-27-15-6-16-28-40)46(36-55)48(44(38-23-11-4-12-24-38)34-53-41-29-17-7-18-30-41)51(57-2)49(50)45(39-25-13-5-14-26-39)35-54-42-31-19-8-20-32-42;1-46-42-37(26-15-27-38(42)40(32-18-8-3-9-19-32)29-44-34-22-12-5-13-23-34)35-24-14-25-36(41(35)30-45)39(31-16-6-2-7-17-31)28-43-33-20-10-4-11-21-33;1-40-36-22-29(26-39)32(34(27-14-6-2-7-15-27)24-37-30-18-10-4-11-19-30)23-33(36)35(28-16-8-3-9-17-28)25-38-31-20-12-5-13-21-31/h7-49H,1-6H3;3-32,55H,36H2,1-2H3;2-27,45H,30H2,1H3;2-23,39H,26H2,1H3
InChIKeyRPOVRLUXWHXMCC-UHFFFAOYSA-N
XLogP46.96
TPSA248.90 Ų
H-Bond Donors3
H-Bond Acceptors20
Rotatable Bonds46
Heavy Atoms223
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002899.57
LogP ≤ 546.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol?
The IUPAC name of 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol (CID 160692486) is 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol.
What is the SMILES notation for 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol?
The canonical SMILES for 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol is COc1c(C(=C=Nc2ccccc2)c2ccccc2)c(CO)c(C(=C=Nc2ccccc2)c2ccccc2)c(OC)c1C(=C=Nc1ccccc1)c1ccccc1.COc1c(C(=C=Nc2ccccc2)c2ccccc2)cccc1-c1cccc(C(=C=Nc2ccccc2)c2ccccc2)c1CO.COc1cc(CO)c(C(=C=Nc2ccccc2)c2ccccc2)cc1C(=C=Nc1ccccc1)c1ccccc1.COc1ccc(C(C)(C)c2ccc(C(C)(c3ccc(OC)c(C(=C=Nc4ccccc4)c4ccccc4)c3)c3ccc(OC)c(C(=C=Nc4ccccc4)c4ccccc4)c3)cc2)cc1C(=C=Nc1ccccc1)c1ccccc1.
What is the InChIKey of 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol?
The InChIKey is RPOVRLUXWHXMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H61N3O3.C51H39N3O3.C42H32N2O2.C36H28N2O2/c1-73(2,58-41-44-70(78-4)64(47-58)67(53-25-13-7-14-26-53)50-75-61-31-19-10-20-32-61)56-37-39-57(40-38-56)74(3,59-42-45-71(79-5)65(48-59)68(54-27-15-8-16-28-54)51-76-62-33-21-11-22-34-62)60-43-46-72(80-6)66(49-60)69(55-29-17-9-18-30-55)52-77-63-35-23-12-24-36-63;1-56-50-47(43(37-21-9-3-10-22-37)33-52-40-27-15-6-16-28-40)46(36-55)48(44(38-23-11-4-12-24-38)34-53-41-29-17-7-18-30-41)51(57-2)49(50)45(39-25-13-5-14-26-39)35-54-42-31-19-8-20-32-42;1-46-42-37(26-15-27-38(42)40(32-18-8-3-9-19-32)29-44-34-22-12-5-13-23-34)35-24-14-25-36(41(35)30-45)39(31-16-6-2-7-17-31)28-43-33-20-10-4-11-21-33;1-40-36-22-29(26-39)32(34(27-14-6-2-7-15-27)24-37-30-18-10-4-11-19-30)23-33(36)35(28-16-8-3-9-17-28)25-38-31-20-12-5-13-21-31/h7-49H,1-6H3;3-32,55H,36H2,1-2H3;2-27,45H,30H2,1H3;2-23,39H,26H2,1H3.
What are the key properties of 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol?
2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol has a molecular weight of 2899.57 g/mol, XLogP of 46.96, 46 rotatable bonds, 3 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[2-[4-[1,1-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]phenyl]propan-2-yl]-2-methoxyphenyl]-N,2-diphenylethenimine;[3,5-dimethoxy-2,4,6-tris(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[5-methoxy-2,4-bis(1-phenyl-2-phenyliminoethenyl)phenyl]methanol;[2-[2-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-6-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol is sourced from PubChem (CID 160692486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).