2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum

C173H118N13O5Pt5S6-5 — CID 162157117

IUPAC2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
SMILESCC(c1[c-]c(-c2cccc3sc(-c4ccccc4O)nc23)ccc1)(c1ccccc1)c1ccccn1.Cc1ccnc(C)c1N(c1[c-]c(-c2cccc3sc(-c4ccccc4O)nc23)ccc1)c1ccccn1.Oc1ccccc1-c1nc2c(-c3[c-]c(C(c4ccccc4)(c4ccccc4)c4ccccn4)ccc3)cccc2s1.Oc1ccccc1-c1nc2c(-c3[c-]c(C(c4ccccc4)(c4ccccc4)c4ccccn4)ccc3)cccc2s1.Oc1ccccc1-c1nc2c(-c3[c-]c(N(c4ccccn4)c4cccc5sc6ccccc6c45)ccc3)cccc2s1.[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C37H25N2OS.C36H22N3OS2.C32H23N2OS.C31H23N4OS.5Pt/c2*40-32-21-8-7-19-31(32)36-39-35-30(20-12-22-33(35)41-36)26-13-11-18-29(25-26)37(27-14-3-1-4-15-27,28-16-5-2-6-17-28)34-23-9-10-24-38-34;40-29-16-3-1-12-26(29)36-38-35-25(14-8-19-32(35)42-36)23-10-7-11-24(22-23)39(33-20-5-6-21-37-33)28-15-9-18-31-34(28)27-13-2-4-17-30(27)41-31;1-32(23-12-3-2-4-13-23,29-19-7-8-20-33-29)24-14-9-11-22(21-24)25-16-10-18-28-30(25)34-31(36-28)26-15-5-6-17-27(26)35;1-20-16-18-32-21(2)30(20)35(28-15-5-6-17-33-28)23-10-7-9-22(19-23)24-12-8-14-27-29(24)34-31(37-27)25-11-3-4-13-26(25)36;;;;;/h2*1-24,40H;1-21,40H;2-20,35H,1H3;3-18,36H,1-2H3;;;;;/q5*-1;;;;;
InChIKeyFFHOVERPOBMZHG-UHFFFAOYSA-N
MW3626.72 g/mol
LogP44.08
Rot. Bonds27

About 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum

2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum (PubChem CID 162157117) has the molecular formula C173H118N13O5Pt5S6-5 and a molecular weight of 3626.72 g/mol. Its IUPAC name is 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
PubChem CID162157117
Molecular FormulaC173H118N13O5Pt5S6-5
Molecular Weight3626.72 g/mol
Exact Mass3623.60
IUPAC Name2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum
SMILESCC(c1[c-]c(-c2cccc3sc(-c4ccccc4O)nc23)ccc1)(c1ccccc1)c1ccccn1.Cc1ccnc(C)c1N(c1[c-]c(-c2cccc3sc(-c4ccccc4O)nc23)ccc1)c1ccccn1.Oc1ccccc1-c1nc2c(-c3[c-]c(C(c4ccccc4)(c4ccccc4)c4ccccn4)ccc3)cccc2s1.Oc1ccccc1-c1nc2c(-c3[c-]c(C(c4ccccc4)(c4ccccc4)c4ccccn4)ccc3)cccc2s1.Oc1ccccc1-c1nc2c(-c3[c-]c(N(c4ccccn4)c4cccc5sc6ccccc6c45)ccc3)cccc2s1.[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C37H25N2OS.C36H22N3OS2.C32H23N2OS.C31H23N4OS.5Pt/c2*40-32-21-8-7-19-31(32)36-39-35-30(20-12-22-33(35)41-36)26-13-11-18-29(25-26)37(27-14-3-1-4-15-27,28-16-5-2-6-17-28)34-23-9-10-24-38-34;40-29-16-3-1-12-26(29)36-38-35-25(14-8-19-32(35)42-36)23-10-7-11-24(22-23)39(33-20-5-6-21-37-33)28-15-9-18-31-34(28)27-13-2-4-17-30(27)41-31;1-32(23-12-3-2-4-13-23,29-19-7-8-20-33-29)24-14-9-11-22(21-24)25-16-10-18-28-30(25)34-31(36-28)26-15-5-6-17-27(26)35;1-20-16-18-32-21(2)30(20)35(28-15-5-6-17-33-28)23-10-7-9-22(19-23)24-12-8-14-27-29(24)34-31(37-27)25-11-3-4-13-26(25)36;;;;;/h2*1-24,40H;1-21,40H;2-20,35H,1H3;3-18,36H,1-2H3;;;;;/q5*-1;;;;;
InChIKeyFFHOVERPOBMZHG-UHFFFAOYSA-N
XLogP44.08
TPSA249.42 Ų
H-Bond Donors5
H-Bond Acceptors24
Rotatable Bonds27
Heavy Atoms202
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003626.72
LogP ≤ 544.08
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum with MolForge

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Related Compounds

2-[3-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-[1]benzothiolo[2,3-c]pyridin-1-yl]phenol;2-[3-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-[1]benzothiolo[2,3-c]pyridin-1-yl]phenol;bis(2-[3-[3-(2-phenyl-N-pyridin-2-ylanilino)benzene-2-id-1-yl]-[1]benzothiolo[2,3-c]pyridin-1-yl]phenol);platinum
CID 158626987
2-[4-[3-[dibenzofuran-4-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-(2,6-dimethyl-4-phenyl-N-pyridin-2-ylanilino)benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-(2,6-dimethyl-N-pyridin-2-ylanilino)benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[(2,6-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum
CID 159223720
2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;methane;platinum
CID 159418074
2-[4-(3,5-ditert-butylphenyl)-6-[3-(2-phenyl-N-pyridin-2-ylanilino)benzene-2-id-1-yl]-2-pyridinyl]phenol;methane;platinum
CID 159267999
2-[3-(4-tert-butyl-2,6-dimethyl-N-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]anilino)benzene-2-id-1-yl]phenol;platinum
CID 164731392
2-[4-[3-[(9,9-dimethylfluoren-4-yl)-pyridin-2-ylamino]phenyl]-1,3-benzothiazol-2-yl]phenol
CID 140902821
2,4-ditert-butyl-6-[4-tert-butyl-6-[3-(2,6-diphenyl-N-pyridin-2-ylanilino)benzene-2-id-1-yl]-1,3,5-triazin-2-yl]phenol;platinum
CID 153280503
4-tert-butyl-2-[6-[3-(N-pyridin-2-ylanilino)benzene-2-id-1-yl]pyrazin-2-yl]phenol;platinum
CID 153280356
2-[6-[3-(2-phenylpropan-2-yl)-5-(N-pyridin-2-ylanilino)benzene-6-id-1-yl]-2-pyridinyl]phenol;platinum
CID 164742111
2-[3-(N-phenylanilino)-5-[3-(N-pyridin-2-ylanilino)benzene-2-id-1-yl]benzene-6-id-1-yl]phenol;platinum(2+)
CID 171752210
2-[6-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-4-phenyl-2-pyridinyl]phenol;platinum
CID 153304079
2-[4-(3,5-ditert-butylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethylphenyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;2-[4-(2,6-dimethyl-4-pyridinyl)-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-2-pyridinyl]phenol;2-[3-[3,5-di(propan-2-yl)phenyl]-6-[3-[naphthalen-1-yl(pyridin-2-yl)amino]-5-phenylbenzene-2-id-1-yl]-2-pyridinyl]phenol;platinum
CID 158217540

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum?
The IUPAC name of 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum (CID 162157117) is 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum.
What is the SMILES notation for 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum?
The canonical SMILES for 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum is CC(c1[c-]c(-c2cccc3sc(-c4ccccc4O)nc23)ccc1)(c1ccccc1)c1ccccn1.Cc1ccnc(C)c1N(c1[c-]c(-c2cccc3sc(-c4ccccc4O)nc23)ccc1)c1ccccn1.Oc1ccccc1-c1nc2c(-c3[c-]c(C(c4ccccc4)(c4ccccc4)c4ccccn4)ccc3)cccc2s1.Oc1ccccc1-c1nc2c(-c3[c-]c(C(c4ccccc4)(c4ccccc4)c4ccccn4)ccc3)cccc2s1.Oc1ccccc1-c1nc2c(-c3[c-]c(N(c4ccccn4)c4cccc5sc6ccccc6c45)ccc3)cccc2s1.[Pt].[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum?
The InChIKey is FFHOVERPOBMZHG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C37H25N2OS.C36H22N3OS2.C32H23N2OS.C31H23N4OS.5Pt/c2*40-32-21-8-7-19-31(32)36-39-35-30(20-12-22-33(35)41-36)26-13-11-18-29(25-26)37(27-14-3-1-4-15-27,28-16-5-2-6-17-28)34-23-9-10-24-38-34;40-29-16-3-1-12-26(29)36-38-35-25(14-8-19-32(35)42-36)23-10-7-11-24(22-23)39(33-20-5-6-21-37-33)28-15-9-18-31-34(28)27-13-2-4-17-30(27)41-31;1-32(23-12-3-2-4-13-23,29-19-7-8-20-33-29)24-14-9-11-22(21-24)25-16-10-18-28-30(25)34-31(36-28)26-15-5-6-17-27(26)35;1-20-16-18-32-21(2)30(20)35(28-15-5-6-17-33-28)23-10-7-9-22(19-23)24-12-8-14-27-29(24)34-31(37-27)25-11-3-4-13-26(25)36;;;;;/h2*1-24,40H;1-21,40H;2-20,35H,1H3;3-18,36H,1-2H3;;;;;/q5*-1;;;;;.
What are the key properties of 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum?
2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum has a molecular weight of 3626.72 g/mol, XLogP of 44.08, 27 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-[dibenzothiophen-1-yl(pyridin-2-yl)amino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;2-[4-[3-[(2,4-dimethyl-3-pyridinyl)-pyridin-2-ylamino]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;bis(2-[4-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol);2-[4-[3-(1-phenyl-1-pyridin-2-ylethyl)benzene-2-id-1-yl]-1,3-benzothiazol-2-yl]phenol;platinum is sourced from PubChem (CID 162157117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).