About 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+)
2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+) (PubChem CID 58401284) has the molecular formula C28H28N2O6Pt
and a molecular weight of 683.62 g/mol. Its IUPAC name is 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+).
Molecular Properties
| Compound Name | 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+) |
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| PubChem CID | 58401284 |
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| Molecular Formula | C28H28N2O6Pt |
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| Molecular Weight | 683.62 g/mol |
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| Exact Mass | 683.16 |
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| IUPAC Name | 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+) |
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| SMILES | COc1c[c-]c(-c2cc(CO)ccn2)c(CO)c1.COc1ccnc(-c2[c-]cc(OC)cc2OC)c1.[Pt+2] |
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| InChI | InChI=1S/2C14H14NO3.Pt/c1-16-10-4-5-12(14(9-10)18-3)13-8-11(17-2)6-7-15-13;1-18-12-2-3-13(11(7-12)9-17)14-6-10(8-16)4-5-15-14;/h4,6-9H,1-3H3;2,4-7,16-17H,8-9H2,1H3;/q2*-1;+2 |
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| InChIKey | FUZMIGINJIHYHJ-UHFFFAOYSA-N |
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| XLogP | 4.11 |
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| TPSA | 103.16 Ų |
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| H-Bond Donors | 2 |
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| H-Bond Acceptors | 8 |
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| Rotatable Bonds | 8 |
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| Heavy Atoms | 37 |
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| Complexity | — |
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Lipinski Rule of Five
1 violation
| Rule | Value |
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| MW ≤ 500 | 683.62 |
| LogP ≤ 5 | 4.11 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 8 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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Analyze 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+) with MolForge
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Frequently Asked Questions
What is the IUPAC name of 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+)?
The IUPAC name of 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+) (CID 58401284) is 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+).
What is the SMILES notation for 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+)?
The canonical SMILES for 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+) is COc1c[c-]c(-c2cc(CO)ccn2)c(CO)c1.COc1ccnc(-c2[c-]cc(OC)cc2OC)c1.[Pt+2].
What is the InChIKey of 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+)?
The InChIKey is FUZMIGINJIHYHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H14NO3.Pt/c1-16-10-4-5-12(14(9-10)18-3)13-8-11(17-2)6-7-15-13;1-18-12-2-3-13(11(7-12)9-17)14-6-10(8-16)4-5-15-14;/h4,6-9H,1-3H3;2,4-7,16-17H,8-9H2,1H3;/q2*-1;+2.
What are the key properties of 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+)?
2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+) has a molecular weight of 683.62 g/mol, XLogP of 4.11, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-[2-(hydroxymethyl)-4-methoxybenzene-6-id-1-yl]-4-pyridinyl]methanol;platinum(2+) is sourced from PubChem (CID 58401284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).