CID 163734619

CKS2 — CID 163734619

IUPAC—
SMILESS=C=S.[K]
InChIInChI=1S/CS2.K/c2-1-3;
InChIKeyLCMPWDXLCCUYKQ-UHFFFAOYSA-N
MW115.24 g/mol
LogP0.64
Rot. Bonds

About CID 163734619

CID 163734619 (PubChem CID 163734619) has the molecular formula CKS2 and a molecular weight of 115.24 g/mol.

Molecular Properties

Compound NameCID 163734619
PubChem CID163734619
Molecular FormulaCKS2
Molecular Weight115.24 g/mol
Exact Mass114.91
IUPAC Name—
SMILESS=C=S.[K]
InChIInChI=1S/CS2.K/c2-1-3;
InChIKeyLCMPWDXLCCUYKQ-UHFFFAOYSA-N
XLogP0.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.24
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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azanium;platinum;isothiocyanate
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Frequently Asked Questions

What is the IUPAC name of CID 163734619?
The IUPAC name of CID 163734619 (CID 163734619) is not available.
What is the SMILES notation for CID 163734619?
The canonical SMILES for CID 163734619 is S=C=S.[K].
What is the InChIKey of CID 163734619?
The InChIKey is LCMPWDXLCCUYKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/CS2.K/c2-1-3;.
What are the key properties of CID 163734619?
CID 163734619 has a molecular weight of 115.24 g/mol, XLogP of 0.64, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 163734619 is sourced from PubChem (CID 163734619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).