azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate

C28H42N4O5Pt — CID 73426196

IUPACazanide;pentadecanoate;phenanthridine;platinum(4+);nitrate
SMILESCCCCCCCCCCCCCCC(=O)[O-].O=[N+]([O-])[O-].[NH2-].[NH2-].[Pt+4].c1ccc2c(c1)cnc1ccccc12
InChIInChI=1S/C15H30O2.C13H9N.NO3.2H2N.Pt/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17;1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13;2-1(3)4;;;/h2-14H2,1H3,(H,16,17);1-9H;;2*1H2;/q;;3*-1;+4/p-1
InChIKeyHZGZUEGMRJWIQL-UHFFFAOYSA-M
MW709.75 g/mol
LogP8.41
Rot. Bonds13

About azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate

azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate (PubChem CID 73426196) has the molecular formula C28H42N4O5Pt and a molecular weight of 709.75 g/mol. Its IUPAC name is azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate.

Molecular Properties

Compound Nameazanide;pentadecanoate;phenanthridine;platinum(4+);nitrate
PubChem CID73426196
Molecular FormulaC28H42N4O5Pt
Molecular Weight709.75 g/mol
Exact Mass709.28
IUPAC Nameazanide;pentadecanoate;phenanthridine;platinum(4+);nitrate
SMILESCCCCCCCCCCCCCCC(=O)[O-].O=[N+]([O-])[O-].[NH2-].[NH2-].[Pt+4].c1ccc2c(c1)cnc1ccccc12
InChIInChI=1S/C15H30O2.C13H9N.NO3.2H2N.Pt/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17;1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13;2-1(3)4;;;/h2-14H2,1H3,(H,16,17);1-9H;;2*1H2;/q;;3*-1;+4/p-1
InChIKeyHZGZUEGMRJWIQL-UHFFFAOYSA-M
XLogP8.41
TPSA186.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500709.75
LogP ≤ 58.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

phenanthridine;platinum(2+)
CID 23616726
1-quinolin-3-yloctan-1-one
CID 114963108
azane;2,2-dimethylbutanoate;nitric acid;phenanthridine;platinum(4+);2,3,3-trimethylbutan-2-yliminomethanediolate;chloride
CID 73426784
phenanthridine
CID 9189
pentakis(cadmium(2+));decakis(decanoate)
CID 157126862
docosanoate;platinum(4+)
CID 173129133
1-quinoxalin-2-ylhexan-1-one
CID 102319889
decanoate;phenylmercury(1+)
CID 70457724
heptanoate;triphenylsulfanium
CID 87067214
phenylazanium;undecanoate
CID 139301589
CID 23623890
CID 23623890
octadecanoate
CID 3033836

Frequently Asked Questions

What is the IUPAC name of azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate?
The IUPAC name of azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate (CID 73426196) is azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate.
What is the SMILES notation for azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate?
The canonical SMILES for azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate is CCCCCCCCCCCCCCC(=O)[O-].O=[N+]([O-])[O-].[NH2-].[NH2-].[Pt+4].c1ccc2c(c1)cnc1ccccc12.
What is the InChIKey of azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate?
The InChIKey is HZGZUEGMRJWIQL-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H30O2.C13H9N.NO3.2H2N.Pt/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17;1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13;2-1(3)4;;;/h2-14H2,1H3,(H,16,17);1-9H;;2*1H2;/q;;3*-1;+4/p-1.
What are the key properties of azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate?
azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate has a molecular weight of 709.75 g/mol, XLogP of 8.41, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;pentadecanoate;phenanthridine;platinum(4+);nitrate is sourced from PubChem (CID 73426196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).