azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride

C5H11Cl2N3O3Pt — CID 46843401

IUPACazane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride
SMILESN.N.O=C(O)Cc1ccno1.[Cl-].[Cl-].[Pt+2]
InChIInChI=1S/C5H5NO3.2ClH.2H3N.Pt/c7-5(8)3-4-1-2-6-9-4;;;;;/h1-2H,3H2,(H,7,8);2*1H;2*1H3;/q;;;;;+2/p-2
InChIKeyNNTYECSDDQZXNT-UHFFFAOYSA-L
MW427.15 g/mol
LogP-5.37
Rot. Bonds2

About azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride

azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride (PubChem CID 46843401) has the molecular formula C5H11Cl2N3O3Pt and a molecular weight of 427.15 g/mol. Its IUPAC name is azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride.

Molecular Properties

Compound Nameazane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride
PubChem CID46843401
Molecular FormulaC5H11Cl2N3O3Pt
Molecular Weight427.15 g/mol
Exact Mass425.98
IUPAC Nameazane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride
SMILESN.N.O=C(O)Cc1ccno1.[Cl-].[Cl-].[Pt+2]
InChIInChI=1S/C5H5NO3.2ClH.2H3N.Pt/c7-5(8)3-4-1-2-6-9-4;;;;;/h1-2H,3H2,(H,7,8);2*1H;2*1H3;/q;;;;;+2/p-2
InChIKeyNNTYECSDDQZXNT-UHFFFAOYSA-L
XLogP-5.37
TPSA133.33 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.15
LogP ≤ 5-5.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride?
The IUPAC name of azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride (CID 46843401) is azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride.
What is the SMILES notation for azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride?
The canonical SMILES for azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride is N.N.O=C(O)Cc1ccno1.[Cl-].[Cl-].[Pt+2].
What is the InChIKey of azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride?
The InChIKey is NNTYECSDDQZXNT-UHFFFAOYSA-L. The full InChI is InChI=1S/C5H5NO3.2ClH.2H3N.Pt/c7-5(8)3-4-1-2-6-9-4;;;;;/h1-2H,3H2,(H,7,8);2*1H;2*1H3;/q;;;;;+2/p-2.
What are the key properties of azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride?
azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride has a molecular weight of 427.15 g/mol, XLogP of -5.37, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-(1,2-oxazol-5-yl)acetic acid;platinum(2+);dichloride is sourced from PubChem (CID 46843401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).