About 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+)
2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+) (PubChem CID 58401436) has the molecular formula C31H34N2O5Pt
and a molecular weight of 709.70 g/mol. Its IUPAC name is 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+).
Molecular Properties
| Compound Name | 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+) |
|---|
| PubChem CID | 58401436 |
|---|
| Molecular Formula | C31H34N2O5Pt |
|---|
| Molecular Weight | 709.70 g/mol |
|---|
| Exact Mass | 709.21 |
|---|
| IUPAC Name | 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+) |
|---|
| SMILES | CCOc1c[c-]c(-c2cc(CO)ccn2)c(C)c1.CCOc1c[c-]c(-c2cc(OC)ccn2)c(OCC)c1.[Pt+2] |
|---|
| InChI | InChI=1S/C16H18NO3.C15H16NO2.Pt/c1-4-19-13-6-7-14(16(11-13)20-5-2)15-10-12(18-3)8-9-17-15;1-3-18-13-4-5-14(11(2)8-13)15-9-12(10-17)6-7-16-15;/h6,8-11H,4-5H2,1-3H3;4,6-9,17H,3,10H2,1-2H3;/q2*-1;+2 |
|---|
| InChIKey | GRZIFWCGJVVZGJ-UHFFFAOYSA-N |
|---|
| XLogP | 6.10 |
|---|
| TPSA | 82.93 Ų |
|---|
| H-Bond Donors | 1 |
|---|
| H-Bond Acceptors | 7 |
|---|
| Rotatable Bonds | 10 |
|---|
| Heavy Atoms | 39 |
|---|
| Complexity | — |
|---|
Lipinski Rule of Five
2 violations
| Rule | Value |
|---|
| MW ≤ 500 | 709.70 |
| LogP ≤ 5 | 6.10 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 7 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
|---|
Analyze 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+) with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+)?
The IUPAC name of 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+) (CID 58401436) is 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+).
What is the SMILES notation for 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+)?
The canonical SMILES for 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+) is CCOc1c[c-]c(-c2cc(CO)ccn2)c(C)c1.CCOc1c[c-]c(-c2cc(OC)ccn2)c(OCC)c1.[Pt+2].
What is the InChIKey of 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+)?
The InChIKey is GRZIFWCGJVVZGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18NO3.C15H16NO2.Pt/c1-4-19-13-6-7-14(16(11-13)20-5-2)15-10-12(18-3)8-9-17-15;1-3-18-13-4-5-14(11(2)8-13)15-9-12(10-17)6-7-16-15;/h6,8-11H,4-5H2,1-3H3;4,6-9,17H,3,10H2,1-2H3;/q2*-1;+2.
What are the key properties of 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+)?
2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+) has a molecular weight of 709.70 g/mol, XLogP of 6.10, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-diethoxybenzene-6-id-1-yl)-4-methoxypyridine;[2-(4-ethoxy-2-methylbenzene-6-id-1-yl)-4-pyridinyl]methanol;platinum(2+) is sourced from PubChem (CID 58401436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).