[2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine

C9H11BrN4S2 — CID 105299200

IUPAC[2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
SMILESCc1nnsc1C(Cc1cc(Br)cs1)NN
InChIInChI=1S/C9H11BrN4S2/c1-5-9(16-14-13-5)8(12-11)3-7-2-6(10)4-15-7/h2,4,8,12H,3,11H2,1H3
InChIKeyBUEKSHQVICIHPK-UHFFFAOYSA-N
MW319.25 g/mol
LogP2.42
Rot. Bonds4

About [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine

[2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine (PubChem CID 105299200) has the molecular formula C9H11BrN4S2 and a molecular weight of 319.25 g/mol. Its IUPAC name is [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
PubChem CID105299200
Molecular FormulaC9H11BrN4S2
Molecular Weight319.25 g/mol
Exact Mass317.96
IUPAC Name[2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
SMILESCc1nnsc1C(Cc1cc(Br)cs1)NN
InChIInChI=1S/C9H11BrN4S2/c1-5-9(16-14-13-5)8(12-11)3-7-2-6(10)4-15-7/h2,4,8,12H,3,11H2,1H3
InChIKeyBUEKSHQVICIHPK-UHFFFAOYSA-N
XLogP2.42
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.25
LogP ≤ 52.42
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 [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine (CID 105299200) is [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine is Cc1nnsc1C(Cc1cc(Br)cs1)NN.
What is the InChIKey of [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine?
The InChIKey is BUEKSHQVICIHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN4S2/c1-5-9(16-14-13-5)8(12-11)3-7-2-6(10)4-15-7/h2,4,8,12H,3,11H2,1H3.
What are the key properties of [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine?
[2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine has a molecular weight of 319.25 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromothiophen-2-yl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105299200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).