tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole

C132H72N16Pt4S8 — CID 157180435

IUPACtetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole
SMILES[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2cc(-c3nccs3)ccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2ccc(-c3nccs3)cn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2cccc(-c3nccs3)n2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2ncccc2-c2nccs2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21
InChIInChI=1S/4C33H18N4S2.4Pt/c1-3-12-28-24(9-1)25-15-14-22(32-36-27-11-2-4-13-30(27)39-32)20-29(25)37(28)23-8-5-7-21(19-23)31-26(10-6-16-34-31)33-35-17-18-38-33;1-3-13-29-24(9-1)25-16-15-22(32-36-27-10-2-4-14-31(27)39-32)20-30(25)37(29)23-8-5-7-21(19-23)26-11-6-12-28(35-26)33-34-17-18-38-33;1-3-10-29-25(8-1)26-14-12-22(33-36-28-9-2-4-11-31(28)39-33)19-30(26)37(29)24-7-5-6-21(18-24)27-15-13-23(20-35-27)32-34-16-17-38-32;1-3-10-29-25(8-1)26-13-12-22(33-36-27-9-2-4-11-31(27)39-33)20-30(26)37(29)24-7-5-6-21(18-24)28-19-23(14-15-34-28)32-35-16-17-38-32;;;;/h2*1-18H;1-17,20H;1-17,19H;;;;/q4*-2;4*+2
InChIKeyQSKIKNOGNWWTLM-UHFFFAOYSA-N
MW2918.99 g/mol
LogP35.38
Rot. Bonds16

About tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole

tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole (PubChem CID 157180435) has the molecular formula C132H72N16Pt4S8 and a molecular weight of 2918.99 g/mol. Its IUPAC name is tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole.

Molecular Properties

Compound Nametetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole
PubChem CID157180435
Molecular FormulaC132H72N16Pt4S8
Molecular Weight2918.99 g/mol
Exact Mass2916.25
IUPAC Nametetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole
SMILES[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2cc(-c3nccs3)ccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2ccc(-c3nccs3)cn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2cccc(-c3nccs3)n2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2ncccc2-c2nccs2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21
InChIInChI=1S/4C33H18N4S2.4Pt/c1-3-12-28-24(9-1)25-15-14-22(32-36-27-11-2-4-13-30(27)39-32)20-29(25)37(28)23-8-5-7-21(19-23)31-26(10-6-16-34-31)33-35-17-18-38-33;1-3-13-29-24(9-1)25-16-15-22(32-36-27-10-2-4-14-31(27)39-32)20-30(25)37(29)23-8-5-7-21(19-23)26-11-6-12-28(35-26)33-34-17-18-38-33;1-3-10-29-25(8-1)26-14-12-22(33-36-28-9-2-4-11-31(28)39-33)19-30(26)37(29)24-7-5-6-21(18-24)27-15-13-23(20-35-27)32-34-16-17-38-32;1-3-10-29-25(8-1)26-13-12-22(33-36-27-9-2-4-11-31(27)39-33)20-30(26)37(29)24-7-5-6-21(18-24)28-19-23(14-15-34-28)32-35-16-17-38-32;;;;/h2*1-18H;1-17,20H;1-17,19H;;;;/q4*-2;4*+2
InChIKeyQSKIKNOGNWWTLM-UHFFFAOYSA-N
XLogP35.38
TPSA174.40 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds16
Heavy Atoms160
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002918.99
LogP ≤ 535.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole?
The IUPAC name of tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole (CID 157180435) is tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole.
What is the SMILES notation for tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole?
The canonical SMILES for tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole is [Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2cc(-c3nccs3)ccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2ccc(-c3nccs3)cn2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2cccc(-c3nccs3)n2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.[c-]1c(-c2ncccc2-c2nccs2)cccc1-n1c2[c-]c(-c3nc4ccccc4s3)ccc2c2ccccc21.
What is the InChIKey of tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole?
The InChIKey is QSKIKNOGNWWTLM-UHFFFAOYSA-N. The full InChI is InChI=1S/4C33H18N4S2.4Pt/c1-3-12-28-24(9-1)25-15-14-22(32-36-27-11-2-4-13-30(27)39-32)20-29(25)37(28)23-8-5-7-21(19-23)31-26(10-6-16-34-31)33-35-17-18-38-33;1-3-13-29-24(9-1)25-16-15-22(32-36-27-10-2-4-14-31(27)39-32)20-30(25)37(29)23-8-5-7-21(19-23)26-11-6-12-28(35-26)33-34-17-18-38-33;1-3-10-29-25(8-1)26-14-12-22(33-36-28-9-2-4-11-31(28)39-33)19-30(26)37(29)24-7-5-6-21(18-24)27-15-13-23(20-35-27)32-34-16-17-38-32;1-3-10-29-25(8-1)26-13-12-22(33-36-27-9-2-4-11-31(27)39-33)20-30(26)37(29)24-7-5-6-21(18-24)28-19-23(14-15-34-28)32-35-16-17-38-32;;;;/h2*1-18H;1-17,20H;1-17,19H;;;;/q4*-2;4*+2.
What are the key properties of tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole?
tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole has a molecular weight of 2918.99 g/mol, XLogP of 35.38, 16 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(platinum(2+));2-[9-[3-[3-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[4-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[5-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole;2-[9-[3-[6-(1,3-thiazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzothiazole is sourced from PubChem (CID 157180435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).