2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum

C136H108N8O4Pt4S4-4 — CID 158543823

IUPAC2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2[c-]c(-c3ccccn3)cc(-c3ccccc3)c2)c2nc(-c3ccccc3O)sc2c1.CC(C)(C)c1ccnc(-c2[c-]c(-c3cc(C(C)(C)C)cc4sc(-c5ccccc5O)nc34)cc(-c3ccccc3)c2)c1.CC(C)(C)c1ccnc(-c2[c-]c(-c3cccc4sc(-c5ccccc5O)nc34)cc(-c3ccccc3)c2)c1.Oc1ccccc1-c1nc2c(-c3[c-]c(-c4ccccn4)cc(-c4ccccc4)c3)cccc2s1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C38H35N2OS.2C34H27N2OS.C30H19N2OS.4Pt/c1-37(2,3)28-16-17-39-32(22-28)27-19-25(24-12-8-7-9-13-24)18-26(20-27)31-21-29(38(4,5)6)23-34-35(31)40-36(42-34)30-14-10-11-15-33(30)41;1-34(2,3)26-20-28(32-31(21-26)38-33(36-32)27-13-7-8-15-30(27)37)24-17-23(22-11-5-4-6-12-22)18-25(19-24)29-14-9-10-16-35-29;1-34(2,3)26-16-17-35-29(21-26)25-19-23(22-10-5-4-6-11-22)18-24(20-25)27-13-9-15-31-32(27)36-33(38-31)28-12-7-8-14-30(28)37;33-27-14-5-4-11-25(27)30-32-29-24(12-8-15-28(29)34-30)22-17-21(20-9-2-1-3-10-20)18-23(19-22)26-13-6-7-16-31-26;;;;/h7-19,21-23,41H,1-6H3;4-18,20-21,37H,1-3H3;4-19,21,37H,1-3H3;1-18,33H;;;;/q4*-1;;;;
InChIKeyZVJNUXKIGGGRQW-UHFFFAOYSA-N
MW2826.99 g/mol
LogP36.64
Rot. Bonds16

About 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum

2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum (PubChem CID 158543823) has the molecular formula C136H108N8O4Pt4S4-4 and a molecular weight of 2826.99 g/mol. Its IUPAC name is 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum
PubChem CID158543823
Molecular FormulaC136H108N8O4Pt4S4-4
Molecular Weight2826.99 g/mol
Exact Mass2824.60
IUPAC Name2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2[c-]c(-c3ccccn3)cc(-c3ccccc3)c2)c2nc(-c3ccccc3O)sc2c1.CC(C)(C)c1ccnc(-c2[c-]c(-c3cc(C(C)(C)C)cc4sc(-c5ccccc5O)nc34)cc(-c3ccccc3)c2)c1.CC(C)(C)c1ccnc(-c2[c-]c(-c3cccc4sc(-c5ccccc5O)nc34)cc(-c3ccccc3)c2)c1.Oc1ccccc1-c1nc2c(-c3[c-]c(-c4ccccn4)cc(-c4ccccc4)c3)cccc2s1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C38H35N2OS.2C34H27N2OS.C30H19N2OS.4Pt/c1-37(2,3)28-16-17-39-32(22-28)27-19-25(24-12-8-7-9-13-24)18-26(20-27)31-21-29(38(4,5)6)23-34-35(31)40-36(42-34)30-14-10-11-15-33(30)41;1-34(2,3)26-20-28(32-31(21-26)38-33(36-32)27-13-7-8-15-30(27)37)24-17-23(22-11-5-4-6-12-22)18-25(19-24)29-14-9-10-16-35-29;1-34(2,3)26-16-17-35-29(21-26)25-19-23(22-10-5-4-6-11-22)18-24(20-25)27-13-9-15-31-32(27)36-33(38-31)28-12-7-8-14-30(28)37;33-27-14-5-4-11-25(27)30-32-29-24(12-8-15-28(29)34-30)22-17-21(20-9-2-1-3-10-20)18-23(19-22)26-13-6-7-16-31-26;;;;/h7-19,21-23,41H,1-6H3;4-18,20-21,37H,1-3H3;4-19,21,37H,1-3H3;1-18,33H;;;;/q4*-1;;;;
InChIKeyZVJNUXKIGGGRQW-UHFFFAOYSA-N
XLogP36.64
TPSA184.04 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds16
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002826.99
LogP ≤ 536.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Tert-butyl-2-[4-[3-(6-tert-butyl-4-methylquinolin-8-yl)benzene-2-id-1-yl]-6-[4-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-yl]phenol;platinum
CID 177110885
2-[[2-(6-Tert-butyl-4-quinolin-8-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]-4-fluorophenol
CID 141679494
2,4-Ditert-butyl-6-[[2-(6-tert-butyl-4-quinolin-8-yl-1,3-benzothiazol-2-yl)phenyl]iminomethyl]phenol
CID 141679960
2-(6-Tert-butyl-4-quinolin-8-yl-1,3-benzothiazol-2-yl)phenol
CID 141680709
2-[4-[2,4-Ditert-butyl-5-[4-(3,5-ditert-butylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
CID 145768266
2-[6-tert-butyl-4-(3-pyridin-2-yl-2H-naphthalen-2-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum
CID 145768268
2-[6-Tert-butyl-4-(3-isoquinolin-3-ylbenzene-2-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum
CID 145768284
2-[6-Tert-butyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum
CID 145768292
2-[4-[3-(4-Tert-butyl-2-pyridinyl)-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
CID 145768312
2-[6-tert-butyl-4-(4-isoquinolin-3-yl-3H-naphthalen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenol;platinum
CID 145768322
2-[4-(4-isoquinolin-3-yl-3H-naphthalen-3-id-2-yl)-1,3-benzothiazol-2-yl]phenol;platinum
CID 145768328
2-[6-Tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-[3,5-di(propan-2-yl)phenyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
CID 145768338

Frequently Asked Questions

What is the IUPAC name of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum?
The IUPAC name of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum (CID 158543823) is 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum.
What is the SMILES notation for 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum?
The canonical SMILES for 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2[c-]c(-c3ccccn3)cc(-c3ccccc3)c2)c2nc(-c3ccccc3O)sc2c1.CC(C)(C)c1ccnc(-c2[c-]c(-c3cc(C(C)(C)C)cc4sc(-c5ccccc5O)nc34)cc(-c3ccccc3)c2)c1.CC(C)(C)c1ccnc(-c2[c-]c(-c3cccc4sc(-c5ccccc5O)nc34)cc(-c3ccccc3)c2)c1.Oc1ccccc1-c1nc2c(-c3[c-]c(-c4ccccn4)cc(-c4ccccc4)c3)cccc2s1.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum?
The InChIKey is ZVJNUXKIGGGRQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H35N2OS.2C34H27N2OS.C30H19N2OS.4Pt/c1-37(2,3)28-16-17-39-32(22-28)27-19-25(24-12-8-7-9-13-24)18-26(20-27)31-21-29(38(4,5)6)23-34-35(31)40-36(42-34)30-14-10-11-15-33(30)41;1-34(2,3)26-20-28(32-31(21-26)38-33(36-32)27-13-7-8-15-30(27)37)24-17-23(22-11-5-4-6-12-22)18-25(19-24)29-14-9-10-16-35-29;1-34(2,3)26-16-17-35-29(21-26)25-19-23(22-10-5-4-6-11-22)18-24(20-25)27-13-9-15-31-32(27)36-33(38-31)28-12-7-8-14-30(28)37;33-27-14-5-4-11-25(27)30-32-29-24(12-8-15-28(29)34-30)22-17-21(20-9-2-1-3-10-20)18-23(19-22)26-13-6-7-16-31-26;;;;/h7-19,21-23,41H,1-6H3;4-18,20-21,37H,1-3H3;4-19,21,37H,1-3H3;1-18,33H;;;;/q4*-1;;;;.
What are the key properties of 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum?
2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum has a molecular weight of 2826.99 g/mol, XLogP of 36.64, 16 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-tert-butyl-4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[6-tert-butyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-phenylbenzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1,3-benzothiazol-2-yl]phenol;platinum is sourced from PubChem (CID 158543823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).