[2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine

C10H11BrN4S — CID 105284531

IUPAC[2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine
SMILESNNC(Cc1cccc(Br)c1)c1cnsn1
InChIInChI=1S/C10H11BrN4S/c11-8-3-1-2-7(4-8)5-9(14-12)10-6-13-16-15-10/h1-4,6,9,14H,5,12H2
InChIKeyWFSWCRITLJMLQA-UHFFFAOYSA-N
MW299.20 g/mol
LogP2.05
Rot. Bonds4

About [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine

[2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine (PubChem CID 105284531) has the molecular formula C10H11BrN4S and a molecular weight of 299.20 g/mol. Its IUPAC name is [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine
PubChem CID105284531
Molecular FormulaC10H11BrN4S
Molecular Weight299.20 g/mol
Exact Mass297.99
IUPAC Name[2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine
SMILESNNC(Cc1cccc(Br)c1)c1cnsn1
InChIInChI=1S/C10H11BrN4S/c11-8-3-1-2-7(4-8)5-9(14-12)10-6-13-16-15-10/h1-4,6,9,14H,5,12H2
InChIKeyWFSWCRITLJMLQA-UHFFFAOYSA-N
XLogP2.05
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.20
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine (CID 105284531) is [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine is NNC(Cc1cccc(Br)c1)c1cnsn1.
What is the InChIKey of [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine?
The InChIKey is WFSWCRITLJMLQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN4S/c11-8-3-1-2-7(4-8)5-9(14-12)10-6-13-16-15-10/h1-4,6,9,14H,5,12H2.
What are the key properties of [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine?
[2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine has a molecular weight of 299.20 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromophenyl)-1-(1,2,5-thiadiazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105284531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).