bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc

C4H6MnN6S4Zn — CID 175338258

IUPACbis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc
SMILESNc1n[nH]c(=S)s1.Nc1n[nH]c(=S)s1.[Mn].[Zn]
InChIInChI=1S/2C2H3N3S2.Mn.Zn/c2*3-1-4-5-2(6)7-1;;/h2*(H2,3,4)(H,5,6);;
InChIKeyBTTMRFDWVUCWBG-UHFFFAOYSA-N
MW386.73 g/mol
LogP1.56
Rot. Bonds

About bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc

bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc (PubChem CID 175338258) has the molecular formula C4H6MnN6S4Zn and a molecular weight of 386.73 g/mol. Its IUPAC name is bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc.

Molecular Properties

Compound Namebis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc
PubChem CID175338258
Molecular FormulaC4H6MnN6S4Zn
Molecular Weight386.73 g/mol
Exact Mass384.82
IUPAC Namebis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc
SMILESNc1n[nH]c(=S)s1.Nc1n[nH]c(=S)s1.[Mn].[Zn]
InChIInChI=1S/2C2H3N3S2.Mn.Zn/c2*3-1-4-5-2(6)7-1;;/h2*(H2,3,4)(H,5,6);;
InChIKeyBTTMRFDWVUCWBG-UHFFFAOYSA-N
XLogP1.56
TPSA109.40 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.73
LogP ≤ 51.56
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc?
The IUPAC name of bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc (CID 175338258) is bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc.
What is the SMILES notation for bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc?
The canonical SMILES for bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc is Nc1n[nH]c(=S)s1.Nc1n[nH]c(=S)s1.[Mn].[Zn].
What is the InChIKey of bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc?
The InChIKey is BTTMRFDWVUCWBG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H3N3S2.Mn.Zn/c2*3-1-4-5-2(6)7-1;;/h2*(H2,3,4)(H,5,6);;.
What are the key properties of bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc?
bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc has a molecular weight of 386.73 g/mol, XLogP of 1.56, 0 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(5-amino-3H-1,3,4-thiadiazole-2-thione);manganese;zinc is sourced from PubChem (CID 175338258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).