carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)

C5H6N2OSW — CID 178117150

IUPACcarbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)
SMILES[CH3-].[NH-]C(=O)c1nccs1.[W+2]
InChIInChI=1S/C4H4N2OS.CH3.W/c5-3(7)4-6-1-2-8-4;;/h1-2H,(H2,5,7);1H3;/q;-1;+2/p-1
InChIKeyCKNROYFBDWSXHA-UHFFFAOYSA-M
MW326.02 g/mol
LogP1.78
Rot. Bonds1

About carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)

carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+) (PubChem CID 178117150) has the molecular formula C5H6N2OSW and a molecular weight of 326.02 g/mol. Its IUPAC name is carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+).

Molecular Properties

Compound Namecarbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)
PubChem CID178117150
Molecular FormulaC5H6N2OSW
Molecular Weight326.02 g/mol
Exact Mass325.97
IUPAC Namecarbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)
SMILES[CH3-].[NH-]C(=O)c1nccs1.[W+2]
InChIInChI=1S/C4H4N2OS.CH3.W/c5-3(7)4-6-1-2-8-4;;/h1-2H,(H2,5,7);1H3;/q;-1;+2/p-1
InChIKeyCKNROYFBDWSXHA-UHFFFAOYSA-M
XLogP1.78
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.02
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

CID 69459233
CID 69459233
potassium;hydride;1,3-thiazole-2-carboxylic acid
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(Z)-2-(1,3-thiazol-2-yl)but-2-enediamide
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hydroxymethyl 1,3-thiazole-2-carboxylate
CID 145074713
ethyl 1,3-thiazole-2-carboxylate;1,3-thiazole-2-carboxamide
CID 159602190
2-(1,3-thiazol-2-yl)prop-2-enehydrazide
CID 146268564
2-amino-3-methyl-1-(1,3-thiazol-2-yl)butan-1-one
CID 19810433
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N-pentyl-1,3-thiazole-2-carboxamide
CID 110695980

Frequently Asked Questions

What is the IUPAC name of carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)?
The IUPAC name of carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+) (CID 178117150) is carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+).
What is the SMILES notation for carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)?
The canonical SMILES for carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+) is [CH3-].[NH-]C(=O)c1nccs1.[W+2].
What is the InChIKey of carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)?
The InChIKey is CKNROYFBDWSXHA-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H4N2OS.CH3.W/c5-3(7)4-6-1-2-8-4;;/h1-2H,(H2,5,7);1H3;/q;-1;+2/p-1.
What are the key properties of carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+)?
carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+) has a molecular weight of 326.02 g/mol, XLogP of 1.78, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;1,3-thiazole-2-carbonylazanide;tungsten(2+) is sourced from PubChem (CID 178117150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).