bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid

C125H124N9O12Pt4S6-3 — CID 159803997

About bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid

bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid (PubChem CID 159803997) has the molecular formula C125H124N9O12Pt4S6-3 and a molecular weight of 2917.13 g/mol. Its IUPAC name is bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid.

Molecular Properties

• Compound Name: bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid
• PubChem CID: 159803997
• Molecular Formula: C125H124N9O12Pt4S6-3
• Molecular Weight: 2917.13 g/mol
• Exact Mass: 2914.63
• IUPAC Name: bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid
• SMILES: CC(=O)C=C(C)O.CC(=O)C=C(C)O.CNCc1ccnc(-c2[c-]cc(Oc3c(C)cc(C)cc3C)cc2Oc2c(C)cc(C)cc2C)c1.CNCc1ccnc(-c2[c-]cc(Sc3ccccc3)cc2Sc2ccccc2)c1.CNCc1ccnc(-c2[c-]cc(Sc3ccccc3)cc2Sc2ccccc2)c1.COc1c[c-]c(-c2cc(CS)ccn2)c(CO)c1.COc1c[c-]c(-c2cc(SC)ccn2)c(OC)c1.O=C(O)c1ccccn1.[Pt+2].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C31H33N2O2.2C25H21N2S2.2C14H14NO2S.C6H5NO2.2C5H8O2.4Pt/c1-19-12-21(3)30(22(4)13-19)34-26-8-9-27(28-16-25(18-32-7)10-11-33-28)29(17-26)35-31-23(5)14-20(2)15-24(31)6;2*1-26-18-19-14-15-27-24(16-19)23-13-12-22(28-20-8-4-2-5-9-20)17-25(23)29-21-10-6-3-7-11-21;1-16-10-4-5-12(14(8-10)17-2)13-9-11(18-3)6-7-15-13;1-17-12-2-3-13(11(7-12)8-16)14-6-10(9-18)4-5-15-14;8-6(9)5-3-1-2-4-7-5;2*1-4(6)3-5(2)7;;;;/h8,10-17,32H,18H2,1-7H3;2*2-12,14-17,26H,18H2,1H3;4,6-9H,1-3H3;2,4-7,16,18H,8-9H2,1H3;1-4H,(H,8,9);2*3,6H,1-2H3;;;;/q5*-1;;;;;;;+2
• InChIKey: LRKSPJJQYUHNGF-UHFFFAOYSA-N
• XLogP: 29.46
• TPSA: 291.71 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 26
• Rotatable Bonds: 32
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2917.13
LogP ≤ 5	29.46
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid?

The IUPAC name of bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid (CID 159803997) is bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid.

What is the SMILES notation for bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid?

The canonical SMILES for bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid is CC(=O)C=C(C)O.CC(=O)C=C(C)O.CNCc1ccnc(-c2[c-]cc(Oc3c(C)cc(C)cc3C)cc2Oc2c(C)cc(C)cc2C)c1.CNCc1ccnc(-c2[c-]cc(Sc3ccccc3)cc2Sc2ccccc2)c1.CNCc1ccnc(-c2[c-]cc(Sc3ccccc3)cc2Sc2ccccc2)c1.COc1c[c-]c(-c2cc(CS)ccn2)c(CO)c1.COc1c[c-]c(-c2cc(SC)ccn2)c(OC)c1.O=C(O)c1ccccn1.[Pt+2].[Pt].[Pt].[Pt].

What is the InChIKey of bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid?

The InChIKey is LRKSPJJQYUHNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H33N2O2.2C25H21N2S2.2C14H14NO2S.C6H5NO2.2C5H8O2.4Pt/c1-19-12-21(3)30(22(4)13-19)34-26-8-9-27(28-16-25(18-32-7)10-11-33-28)29(17-26)35-31-23(5)14-20(2)15-24(31)6;2*1-26-18-19-14-15-27-24(16-19)23-13-12-22(28-20-8-4-2-5-9-20)17-25(23)29-21-10-6-3-7-11-21;1-16-10-4-5-12(14(8-10)17-2)13-9-11(18-3)6-7-15-13;1-17-12-2-3-13(11(7-12)8-16)14-6-10(9-18)4-5-15-14;8-6(9)5-3-1-2-4-7-5;2*1-4(6)3-5(2)7;;;;/h8,10-17,32H,18H2,1-7H3;2*2-12,14-17,26H,18H2,1H3;4,6-9H,1-3H3;2,4-7,16,18H,8-9H2,1H3;1-4H,(H,8,9);2*3,6H,1-2H3;;;;/q5*-1;;;;;;;+2.

What are the key properties of bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid?

bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid has a molecular weight of 2917.13 g/mol, XLogP of 29.46, 32 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for bis(1-[2-[2,4-bis(phenylsulfanyl)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine);1-[2-[2,4-bis(2,4,6-trimethylphenoxy)benzene-6-id-1-yl]-4-pyridinyl]-N-methylmethanamine;2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methylsulfanylpyridine;bis(4-hydroxypent-3-en-2-one);[5-methoxy-2-[4-(sulfanylmethyl)-2-pyridinyl]benzene-3-id-1-yl]methanol;platinum;platinum(2+);pyridine-2-carboxylic acid is sourced from PubChem (CID 159803997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).