(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride

C6H7ClN4S2 — CID 45263024

IUPAC(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride
SMILESCl.NNc1nnc(-c2ccsc2)s1
InChIInChI=1S/C6H6N4S2.ClH/c7-8-6-10-9-5(12-6)4-1-2-11-3-4;/h1-3H,7H2,(H,8,10);1H
InChIKeyPCNLUPQLHAFRCK-UHFFFAOYSA-N
MW234.74 g/mol
LogP1.97
Rot. Bonds2

About (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride

(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride (PubChem CID 45263024) has the molecular formula C6H7ClN4S2 and a molecular weight of 234.74 g/mol. Its IUPAC name is (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride.

Molecular Properties

Compound Name(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride
PubChem CID45263024
Molecular FormulaC6H7ClN4S2
Molecular Weight234.74 g/mol
Exact Mass233.98
IUPAC Name(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride
SMILESCl.NNc1nnc(-c2ccsc2)s1
InChIInChI=1S/C6H6N4S2.ClH/c7-8-6-10-9-5(12-6)4-1-2-11-3-4;/h1-3H,7H2,(H,8,10);1H
InChIKeyPCNLUPQLHAFRCK-UHFFFAOYSA-N
XLogP1.97
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.74
LogP ≤ 51.97
H-Bond Donors ≤ 52
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 (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride?
The IUPAC name of (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride (CID 45263024) is (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride.
What is the SMILES notation for (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride?
The canonical SMILES for (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride is Cl.NNc1nnc(-c2ccsc2)s1.
What is the InChIKey of (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride?
The InChIKey is PCNLUPQLHAFRCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4S2.ClH/c7-8-6-10-9-5(12-6)4-1-2-11-3-4;/h1-3H,7H2,(H,8,10);1H.
What are the key properties of (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride?
(5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride has a molecular weight of 234.74 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-thiophen-3-yl-1,3,4-thiadiazol-2-yl)hydrazine;hydrochloride is sourced from PubChem (CID 45263024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).