About [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+)
[(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+) (PubChem CID 134837226) has the molecular formula C19H23Cl2N7Pt
and a molecular weight of 615.43 g/mol. Its IUPAC name is [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+).
Molecular Properties
| Compound Name | [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+) |
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| PubChem CID | 134837226 |
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| Molecular Formula | C19H23Cl2N7Pt |
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| Molecular Weight | 615.43 g/mol |
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| Exact Mass | 614.10 |
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| IUPAC Name | [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+) |
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| SMILES | Cl[Pt+2]Cl.[H]N=C(N(C(=[N-])N(C)C)c1ccccc1)N(C(=[N-])N(C)C)c1ccccc1 |
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| InChI | InChI=1S/C19H23N7.2ClH.Pt/c1-23(2)17(20)25(15-11-7-5-8-12-15)19(22)26(18(21)24(3)4)16-13-9-6-10-14-16;;;/h5-14,22H,1-4H3;2*1H;/q-2;;;+4/p-2 |
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| InChIKey | DRIOTEPNMXWNHL-UHFFFAOYSA-L |
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| XLogP | 4.28 |
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| TPSA | 81.41 Ų |
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| H-Bond Donors | 1 |
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| H-Bond Acceptors | 1 |
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| Rotatable Bonds | 2 |
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| Heavy Atoms | 29 |
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| Complexity | — |
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Lipinski Rule of Five
1 violation
| Rule | Value |
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| MW ≤ 500 | 615.43 |
| LogP ≤ 5 | 4.28 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+)?
The IUPAC name of [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+) (CID 134837226) is [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+).
What is the SMILES notation for [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+)?
The canonical SMILES for [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+) is Cl[Pt+2]Cl.[H]N=C(N(C(=[N-])N(C)C)c1ccccc1)N(C(=[N-])N(C)C)c1ccccc1.
What is the InChIKey of [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+)?
The InChIKey is DRIOTEPNMXWNHL-UHFFFAOYSA-L. The full InChI is InChI=1S/C19H23N7.2ClH.Pt/c1-23(2)17(20)25(15-11-7-5-8-12-15)19(22)26(18(21)24(3)4)16-13-9-6-10-14-16;;;/h5-14,22H,1-4H3;2*1H;/q-2;;;+4/p-2.
What are the key properties of [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+)?
[(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+) has a molecular weight of 615.43 g/mol, XLogP of 4.28, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(N-[N-[azanidylidene(dimethylamino)methyl]-N-phenylcarbamimidoyl]anilino)-(dimethylamino)methylidene]azanide;dichloroplatinum(2+) is sourced from PubChem (CID 134837226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).