CID 87784182

C2H4F6KN2O4S2 — CID 87784182

IUPAC
SMILESNS(=O)(=O)C(F)(F)F.NS(=O)(=O)C(F)(F)F.[K]
InChIInChI=1S/2CH2F3NO2S.K/c2*2-1(3,4)8(5,6)7;/h2*(H2,5,6,7);
InChIKeyDXZDTDFCQVMXBT-UHFFFAOYSA-N
MW337.28 g/mol
LogP-0.79
Rot. Bonds

About CID 87784182

CID 87784182 (PubChem CID 87784182) has the molecular formula C2H4F6KN2O4S2 and a molecular weight of 337.28 g/mol.

Molecular Properties

Compound NameCID 87784182
PubChem CID87784182
Molecular FormulaC2H4F6KN2O4S2
Molecular Weight337.28 g/mol
Exact Mass336.92
IUPAC Name
SMILESNS(=O)(=O)C(F)(F)F.NS(=O)(=O)C(F)(F)F.[K]
InChIInChI=1S/2CH2F3NO2S.K/c2*2-1(3,4)8(5,6)7;/h2*(H2,5,6,7);
InChIKeyDXZDTDFCQVMXBT-UHFFFAOYSA-N
XLogP-0.79
TPSA120.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.28
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 87784182?
The IUPAC name of CID 87784182 (CID 87784182) is not available.
What is the SMILES notation for CID 87784182?
The canonical SMILES for CID 87784182 is NS(=O)(=O)C(F)(F)F.NS(=O)(=O)C(F)(F)F.[K].
What is the InChIKey of CID 87784182?
The InChIKey is DXZDTDFCQVMXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/2CH2F3NO2S.K/c2*2-1(3,4)8(5,6)7;/h2*(H2,5,6,7);.
What are the key properties of CID 87784182?
CID 87784182 has a molecular weight of 337.28 g/mol, XLogP of -0.79, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87784182 is sourced from PubChem (CID 87784182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).