About dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium
dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium (PubChem CID 5232081) has the molecular formula C31H32Cl2N2O3SnV
and a molecular weight of 721.17 g/mol. Its IUPAC name is dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium.
Molecular Properties
| Compound Name | dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium |
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| PubChem CID | 5232081 |
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| Molecular Formula | C31H32Cl2N2O3SnV |
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| Molecular Weight | 721.17 g/mol |
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| Exact Mass | 721.03 |
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| IUPAC Name | dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium |
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| SMILES | C/C(=N\CC(C)/N=C(\C)c1ccccc1O)c1ccccc1O.Cl[Sn](Cl)(c1ccccc1)c1ccccc1.O=[V] |
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| InChI | InChI=1S/C19H22N2O2.2C6H5.2ClH.O.Sn.V/c1-13(21-15(3)17-9-5-7-11-19(17)23)12-20-14(2)16-8-4-6-10-18(16)22;2*1-2-4-6-5-3-1;;;;;/h4-11,13,22-23H,12H2,1-3H3;2*1-5H;2*1H;;;/q;;;;;;+2;/p-2/b20-14+,21-15+;;;;;;; |
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| InChIKey | YCEIHPGLIGPQDQ-ZEKKBAPQSA-L |
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| XLogP | 6.40 |
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| TPSA | 82.25 Ų |
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| H-Bond Donors | 2 |
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| H-Bond Acceptors | 5 |
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| Rotatable Bonds | 7 |
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| Heavy Atoms | 40 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
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| MW ≤ 500 | 721.17 |
| LogP ≤ 5 | 6.40 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium?
The IUPAC name of dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium (CID 5232081) is dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium.
What is the SMILES notation for dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium?
The canonical SMILES for dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium is C/C(=N\CC(C)/N=C(\C)c1ccccc1O)c1ccccc1O.Cl[Sn](Cl)(c1ccccc1)c1ccccc1.O=[V].
What is the InChIKey of dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium?
The InChIKey is YCEIHPGLIGPQDQ-ZEKKBAPQSA-L. The full InChI is InChI=1S/C19H22N2O2.2C6H5.2ClH.O.Sn.V/c1-13(21-15(3)17-9-5-7-11-19(17)23)12-20-14(2)16-8-4-6-10-18(16)22;2*1-2-4-6-5-3-1;;;;;/h4-11,13,22-23H,12H2,1-3H3;2*1-5H;2*1H;;;/q;;;;;;+2;/p-2/b20-14+,21-15+;;;;;;;.
What are the key properties of dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium?
dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium has a molecular weight of 721.17 g/mol, XLogP of 6.40, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(diphenyl)stannane;2-[N-[2-[1-(2-hydroxyphenyl)ethylideneamino]propyl]-C-methylcarbonimidoyl]phenol;oxovanadium is sourced from PubChem (CID 5232081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).