[5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine

C8H8ClN5S2 — CID 62887225

IUPAC[5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine
SMILESNNc1ccc(Cl)c(CSc2nncs2)n1
InChIInChI=1S/C8H8ClN5S2/c9-5-1-2-7(13-10)12-6(5)3-15-8-14-11-4-16-8/h1-2,4H,3,10H2,(H,12,13)
InChIKeyKAKPDNCVHDFPRO-UHFFFAOYSA-N
MW273.77 g/mol
LogP2.16
Rot. Bonds4

About [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine

[5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine (PubChem CID 62887225) has the molecular formula C8H8ClN5S2 and a molecular weight of 273.77 g/mol. Its IUPAC name is [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine
PubChem CID62887225
Molecular FormulaC8H8ClN5S2
Molecular Weight273.77 g/mol
Exact Mass272.99
IUPAC Name[5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine
SMILESNNc1ccc(Cl)c(CSc2nncs2)n1
InChIInChI=1S/C8H8ClN5S2/c9-5-1-2-7(13-10)12-6(5)3-15-8-14-11-4-16-8/h1-2,4H,3,10H2,(H,12,13)
InChIKeyKAKPDNCVHDFPRO-UHFFFAOYSA-N
XLogP2.16
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.77
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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 [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine?
The IUPAC name of [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine (CID 62887225) is [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine?
The canonical SMILES for [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine is NNc1ccc(Cl)c(CSc2nncs2)n1.
What is the InChIKey of [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine?
The InChIKey is KAKPDNCVHDFPRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN5S2/c9-5-1-2-7(13-10)12-6(5)3-15-8-14-11-4-16-8/h1-2,4H,3,10H2,(H,12,13).
What are the key properties of [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine?
[5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine has a molecular weight of 273.77 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 62887225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).