CID 150781037

H4N4O4S2 — CID 150781037

IUPAC—
SMILESNNNS(=O)(=O)N=S(=O)=O
InChIInChI=1S/H4N4O4S2/c1-2-3-10(7,8)4-9(5)6/h2-3H,1H2
InChIKeyKBWOKTQDAUOOLE-UHFFFAOYSA-N
MW188.19 g/mol
LogP-2.74
Rot. Bonds3

About CID 150781037

CID 150781037 (PubChem CID 150781037) has the molecular formula H4N4O4S2 and a molecular weight of 188.19 g/mol.

Molecular Properties

Compound NameCID 150781037
PubChem CID150781037
Molecular FormulaH4N4O4S2
Molecular Weight188.19 g/mol
Exact Mass187.97
IUPAC Name—
SMILESNNNS(=O)(=O)N=S(=O)=O
InChIInChI=1S/H4N4O4S2/c1-2-3-10(7,8)4-9(5)6/h2-3H,1H2
InChIKeyKBWOKTQDAUOOLE-UHFFFAOYSA-N
XLogP-2.74
TPSA130.72 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 5-2.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 150781037?
The IUPAC name of CID 150781037 (CID 150781037) is not available.
What is the SMILES notation for CID 150781037?
The canonical SMILES for CID 150781037 is NNNS(=O)(=O)N=S(=O)=O.
What is the InChIKey of CID 150781037?
The InChIKey is KBWOKTQDAUOOLE-UHFFFAOYSA-N. The full InChI is InChI=1S/H4N4O4S2/c1-2-3-10(7,8)4-9(5)6/h2-3H,1H2.
What are the key properties of CID 150781037?
CID 150781037 has a molecular weight of 188.19 g/mol, XLogP of -2.74, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 150781037 is sourced from PubChem (CID 150781037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).