N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+))

C187H138N13O2Pt5S6- — CID 159467311

About N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+))

N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+)) (PubChem CID 159467311) has the molecular formula C187H138N13O2Pt5S6- and a molecular weight of 3767.04 g/mol. Its IUPAC name is N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+)).

Molecular Properties

• Compound Name: N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+))
• PubChem CID: 159467311
• Molecular Formula: C187H138N13O2Pt5S6-
• Molecular Weight: 3767.04 g/mol
• Exact Mass: 3763.77
• IUPAC Name: N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+))
• SMILES: CC(C)(C)c1cc(-c2[c-]c3ccccc3o2)c2nc(-c3ccccc3/N=C/c3cc4ccccc4c4ccc[c-]c34)sc2c1.CC(C)(C)c1cc(-c2[c-]c3ccccc3s2)c2nc(-c3ccccc3/N=C/c3cc4ccccc4c4ccc[c-]c34)sc2c1.CC(C)(C)c1cc(-c2ccc[n-]2)c2nc(-c3ccccc3/N=C/c3cc4ccccc4c4ccc[c-]c34)sc2c1.CC(C)(C)c1cc(-c2ccn[n-]2)c2nc(-c3ccccc3/N=C/c3cc4ccccc4c4ccc[c-]c34)sc2c1.CC(C)(C)c1ccc(O)c(/C=N/c2ccccc2-c2nc3c(-c4[c-]cccc4)cc(-c4ccccc4)cc3s2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt]
• InChI: InChI=1S/C40H28N2OS.C40H28N2S2.C36H27N3S.C36H29N2OS.C35H26N4S.5Pt/c2*1-40(2,3)28-22-33(36-21-26-13-5-11-19-35(26)43-36)38-37(23-28)44-39(42-38)32-17-9-10-18-34(32)41-24-27-20-25-12-4-6-14-29(25)31-16-8-7-15-30(27)31;1-36(2,3)25-20-30(32-17-10-18-37-32)34-33(21-25)40-35(39-34)29-15-8-9-16-31(29)38-22-24-19-23-11-4-5-12-26(23)28-14-7-6-13-27(24)28;1-36(2,3)28-18-19-32(39)27(20-28)23-37-31-17-11-10-16-29(31)35-38-34-30(25-14-8-5-9-15-25)21-26(22-33(34)40-35)24-12-6-4-7-13-24;1-35(2,3)24-19-29(31-16-17-37-39-31)33-32(20-24)40-34(38-33)28-14-8-9-15-30(28)36-21-23-18-22-10-4-5-11-25(22)27-13-7-6-12-26(23)27;;;;;/h2*4-14,16-20,22-24H,1-3H3;4-12,14-22H,1-3H3;4-14,16-23,39H,1-3H3;4-11,13-21H,1-3H3;;;;;/q3*-2;-1;-2;;4*+2/b2*41-24+;38-22+;37-23+;36-21+
• InChIKey: JOQBATPIBACDCH-AIPNKHNVSA-N
• XLogP: 51.85
• TPSA: 200.71 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 19
• Rotatable Bonds: 21
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3767.04
LogP ≤ 5	51.85
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+))?

The IUPAC name of N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+)) (CID 159467311) is N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+)).

What is the SMILES notation for N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+))?

The canonical SMILES for N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+)) is CC(C)(C)c1cc(-c2[c-]c3ccccc3o2)c2nc(-c3ccccc3/N=C/c3cc4ccccc4c4ccc[c-]c34)sc2c1.CC(C)(C)c1cc(-c2[c-]c3ccccc3s2)c2nc(-c3ccccc3/N=C/c3cc4ccccc4c4ccc[c-]c34)sc2c1.CC(C)(C)c1cc(-c2ccc[n-]2)c2nc(-c3ccccc3/N=C/c3cc4ccccc4c4ccc[c-]c34)sc2c1.CC(C)(C)c1cc(-c2ccn[n-]2)c2nc(-c3ccccc3/N=C/c3cc4ccccc4c4ccc[c-]c34)sc2c1.CC(C)(C)c1ccc(O)c(/C=N/c2ccccc2-c2nc3c(-c4[c-]cccc4)cc(-c4ccccc4)cc3s2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt].

What is the InChIKey of N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+))?

The InChIKey is JOQBATPIBACDCH-AIPNKHNVSA-N. The full InChI is InChI=1S/C40H28N2OS.C40H28N2S2.C36H27N3S.C36H29N2OS.C35H26N4S.5Pt/c2*1-40(2,3)28-22-33(36-21-26-13-5-11-19-35(26)43-36)38-37(23-28)44-39(42-38)32-17-9-10-18-34(32)41-24-27-20-25-12-4-6-14-29(25)31-16-8-7-15-30(27)31;1-36(2,3)25-20-30(32-17-10-18-37-32)34-33(21-25)40-35(39-34)29-15-8-9-16-31(29)38-22-24-19-23-11-4-5-12-26(23)28-14-7-6-13-27(24)28;1-36(2,3)28-18-19-32(39)27(20-28)23-37-31-17-11-10-16-29(31)35-38-34-30(25-14-8-5-9-15-25)21-26(22-33(34)40-35)24-12-6-4-7-13-24;1-35(2,3)24-19-29(31-16-17-37-39-31)33-32(20-24)40-34(38-33)28-14-8-9-15-30(28)36-21-23-18-22-10-4-5-11-25(22)27-13-7-6-12-26(23)27;;;;;/h2*4-14,16-20,22-24H,1-3H3;4-12,14-22H,1-3H3;4-14,16-23,39H,1-3H3;4-11,13-21H,1-3H3;;;;;/q3*-2;-1;-2;;4*+2/b2*41-24+;38-22+;37-23+;36-21+;;;;;.

What are the key properties of N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+))?

N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+)) has a molecular weight of 3767.04 g/mol, XLogP of 51.85, 21 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[4-(3H-1-benzofuran-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-[4-(3H-1-benzothiophen-3-id-2-yl)-6-tert-butyl-1,3-benzothiazol-2-yl]phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;4-tert-butyl-2-[[2-(6-phenyl-4-phenyl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol;N-[2-(6-tert-butyl-4-pyrazol-2-id-3-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;N-[2-(6-tert-butyl-4-pyrrol-1-id-2-yl-1,3-benzothiazol-2-yl)phenyl]-1-(8H-phenanthren-8-id-9-yl)methanimine;platinum;tetrakis(platinum(2+)) is sourced from PubChem (CID 159467311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).