[6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine

C11H9N5S — CID 62783694

IUPAC[6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine
SMILESNNc1ccc(-c2nc3ccccc3s2)nn1
InChIInChI=1S/C11H9N5S/c12-14-10-6-5-8(15-16-10)11-13-7-3-1-2-4-9(7)17-11/h1-6H,12H2,(H,14,16)
InChIKeyORRCMCJMRINLQE-UHFFFAOYSA-N
MW243.30 g/mol
LogP2.04
Rot. Bonds2

About [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine

[6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine (PubChem CID 62783694) has the molecular formula C11H9N5S and a molecular weight of 243.30 g/mol. Its IUPAC name is [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine.

Molecular Properties

Compound Name[6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine
PubChem CID62783694
Molecular FormulaC11H9N5S
Molecular Weight243.30 g/mol
Exact Mass243.06
IUPAC Name[6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine
SMILESNNc1ccc(-c2nc3ccccc3s2)nn1
InChIInChI=1S/C11H9N5S/c12-14-10-6-5-8(15-16-10)11-13-7-3-1-2-4-9(7)17-11/h1-6H,12H2,(H,14,16)
InChIKeyORRCMCJMRINLQE-UHFFFAOYSA-N
XLogP2.04
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.30
LogP ≤ 52.04
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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Related Compounds

4-(1,3-benzothiazol-2-yl)oxadiazole
CID 68714459
2-(7-fluoroquinolin-2-yl)-1,3-benzothiazole
CID 132941987
iridium;bis(2-phenyl-1,3-benzothiazole)
CID 87517023
2-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-1,3-benzothiazole
CID 854969
2-amino-6-(1,3-benzothiazol-2-yl)phenol
CID 135623123
4-(1,3-benzothiazol-2-yl)benzamide
CID 28689293
2-[4-[7-[4-(1,3-benzothiazol-2-yl)phenyl]naphthalen-2-yl]phenyl]-1,3-benzothiazole
CID 130389356
4-(1,3-benzothiazol-2-yl)aniline;molecular hydrogen
CID 145349668
1-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-2-methylpropan-1-amine
CID 61338213
2-bromo-1,3-benzothiazole;hydrazine
CID 174709808
1-[2-(1,3-benzothiazol-2-yl)phenyl]cyclopropan-1-amine
CID 117420242
dizinc;tetrakis(2-(1,3-benzothiazol-2-yl)phenolate)
CID 139119825

Frequently Asked Questions

What is the IUPAC name of [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine?
The IUPAC name of [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine (CID 62783694) is [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine.
What is the SMILES notation for [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine?
The canonical SMILES for [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine is NNc1ccc(-c2nc3ccccc3s2)nn1.
What is the InChIKey of [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine?
The InChIKey is ORRCMCJMRINLQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5S/c12-14-10-6-5-8(15-16-10)11-13-7-3-1-2-4-9(7)17-11/h1-6H,12H2,(H,14,16).
What are the key properties of [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine?
[6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine has a molecular weight of 243.30 g/mol, XLogP of 2.04, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1,3-benzothiazol-2-yl)pyridazin-3-yl]hydrazine is sourced from PubChem (CID 62783694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).