zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide

C195H184N16O18S6Si4Zn — CID 159335349

About zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide

zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide (PubChem CID 159335349) has the molecular formula C195H184N16O18S6Si4Zn and a molecular weight of 3409.85 g/mol. Its IUPAC name is zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide.

Molecular Properties

• Compound Name: zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide
• PubChem CID: 159335349
• Molecular Formula: C195H184N16O18S6Si4Zn
• Molecular Weight: 3409.85 g/mol
• Exact Mass: 3405.07
• IUPAC Name: zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide
• SMILES: CCO[Si](CCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(-c3cc4cc5c6c(c4oc3=O)C(C)(C)CCN6CCC5(C)C)s2)s1)(OCC)OCC.CCO[Si](CCCNC(=O)/C(C#N)=C/c1sc(-c2sc(-c3sc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4C)cc3C)cc2C)cc1C)(OCC)OCC.CO[Si](OC)(OC)c1ccc(NC(=O)c2ccc(-c3c4nc(c(-c5ccccc5)c5ccc([n-]5)c(-c5ccccc5)c5nc(c(-c6ccccc6)c6ccc3[n-]6)C=C5)C=C4)cc2)cc1.CO[Si](OC)(OC)c1ccc(NC(=O)c2ccc(-c3c4nc(c(-c5ccccc5)c5ccc([nH]5)c(-c5ccccc5)c5nc(c(-c6ccccc6)c6ccc3[nH]6)C=C5)C=C4)cc2)cc1.[Zn+2]
• InChI: InChI=1S/C54H43N5O4Si.C54H42N5O4Si.C47H51N3O4S4Si.C40H49N3O6S2Si.Zn/c2*1-61-64(62-2,63-3)41-25-23-40(24-26-41)55-54(60)39-21-19-38(20-22-39)53-48-33-31-46(58-48)51(36-15-9-5-10-16-36)44-29-27-42(56-44)50(35-13-7-4-8-14-35)43-28-30-45(57-43)52(37-17-11-6-12-18-37)47-32-34-49(53)59-47;1-9-50-37-17-14-13-16-35(37)36-26-33(18-19-38(36)50)40-23-30(6)45(56-40)42-25-32(8)46(58-42)43-24-31(7)44(57-43)41-22-29(5)39(55-41)27-34(28-48)47(51)49-20-15-21-59(52-10-2,53-11-3)54-12-4;1-8-46-52(47-9-2,48-10-3)21-11-18-42-37(44)27(25-41)22-28-12-13-32(50-28)33-15-14-31(51-33)29-23-26-24-30-35-34(36(26)49-38(29)45)40(6,7)17-20-43(35)19-16-39(30,4)5;/h4-34,56,59H,1-3H3,(H,55,60);4-34H,1-3H3,(H2-,55,56,57,58,59,60);13-14,16-19,22-27H,9-12,15,20-21H2,1-8H3,(H,49,51);12-15,22-24H,8-11,16-21H2,1-7H3,(H,42,44);/q;-1;;;+2/p-1/b2*50-42-,50-43-,51-44-,51-46-,52-45-,52-47-,53-48-,53-49-;34-27+;27-22+
• InChIKey: LFLQYTCDNFDANC-ULLLYVITSA-M
• XLogP: 44.88
• TPSA: 424.46 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 32
• Rotatable Bonds: 51
• Heavy Atoms: 240
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3409.85
LogP ≤ 5	44.88
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'conjugated_nitrile_group', 'substructure': 'N/A'}, {'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide?

The IUPAC name of zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide (CID 159335349) is zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide.

What is the SMILES notation for zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide?

The canonical SMILES for zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide is CCO[Si](CCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(-c3cc4cc5c6c(c4oc3=O)C(C)(C)CCN6CCC5(C)C)s2)s1)(OCC)OCC.CCO[Si](CCCNC(=O)/C(C#N)=C/c1sc(-c2sc(-c3sc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4C)cc3C)cc2C)cc1C)(OCC)OCC.CO[Si](OC)(OC)c1ccc(NC(=O)c2ccc(-c3c4nc(c(-c5ccccc5)c5ccc([n-]5)c(-c5ccccc5)c5nc(c(-c6ccccc6)c6ccc3[n-]6)C=C5)C=C4)cc2)cc1.CO[Si](OC)(OC)c1ccc(NC(=O)c2ccc(-c3c4nc(c(-c5ccccc5)c5ccc([nH]5)c(-c5ccccc5)c5nc(c(-c6ccccc6)c6ccc3[nH]6)C=C5)C=C4)cc2)cc1.[Zn+2].

What is the InChIKey of zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide?

The InChIKey is LFLQYTCDNFDANC-ULLLYVITSA-M. The full InChI is InChI=1S/C54H43N5O4Si.C54H42N5O4Si.C47H51N3O4S4Si.C40H49N3O6S2Si.Zn/c2*1-61-64(62-2,63-3)41-25-23-40(24-26-41)55-54(60)39-21-19-38(20-22-39)53-48-33-31-46(58-48)51(36-15-9-5-10-16-36)44-29-27-42(56-44)50(35-13-7-4-8-14-35)43-28-30-45(57-43)52(37-17-11-6-12-18-37)47-32-34-49(53)59-47;1-9-50-37-17-14-13-16-35(37)36-26-33(18-19-38(36)50)40-23-30(6)45(56-40)42-25-32(8)46(58-42)43-24-31(7)44(57-43)41-22-29(5)39(55-41)27-34(28-48)47(51)49-20-15-21-59(52-10-2,53-11-3)54-12-4;1-8-46-52(47-9-2,48-10-3)21-11-18-42-37(44)27(25-41)22-28-12-13-32(50-28)33-15-14-31(51-33)29-23-26-24-30-35-34(36(26)49-38(29)45)40(6,7)17-20-43(35)19-16-39(30,4)5;/h4-34,56,59H,1-3H3,(H,55,60);4-34H,1-3H3,(H2-,55,56,57,58,59,60);13-14,16-19,22-27H,9-12,15,20-21H2,1-8H3,(H,49,51);12-15,22-24H,8-11,16-21H2,1-7H3,(H,42,44);/q;-1;;;+2/p-1/b2*50-42-,50-43-,51-44-,51-46-,52-45-,52-47-,53-48-,53-49-;34-27+;27-22+;.

What are the key properties of zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide?

zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide has a molecular weight of 3409.85 g/mol, XLogP of 44.88, 51 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for zinc;(E)-2-cyano-3-[5-[5-[5-[5-(9-ethylcarbazol-3-yl)-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-3-methylthiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;(E)-2-cyano-3-[5-[5-(10,10,16,16-tetramethyl-4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-5-yl)thiophen-2-yl]thiophen-2-yl]-N-(3-triethoxysilylpropyl)prop-2-enamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzamide;N-(4-trimethoxysilylphenyl)-4-(10,15,20-triphenylporphyrin-22,24-diid-5-yl)benzamide is sourced from PubChem (CID 159335349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).