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

C12H11Br2ClN2S — CID 105299240

IUPAC[1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine
SMILESNNC(Cc1cc(Br)cs1)c1cc(Br)ccc1Cl
InChIInChI=1S/C12H11Br2ClN2S/c13-7-1-2-11(15)10(4-7)12(17-16)5-9-3-8(14)6-18-9/h1-4,6,12,17H,5,16H2
InChIKeyCSAZGYHDKNDABJ-UHFFFAOYSA-N
MW410.56 g/mol
LogP4.67
Rot. Bonds4

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

[1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine (PubChem CID 105299240) has the molecular formula C12H11Br2ClN2S and a molecular weight of 410.56 g/mol. Its IUPAC name is [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine
PubChem CID105299240
Molecular FormulaC12H11Br2ClN2S
Molecular Weight410.56 g/mol
Exact Mass407.87
IUPAC Name[1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine
SMILESNNC(Cc1cc(Br)cs1)c1cc(Br)ccc1Cl
InChIInChI=1S/C12H11Br2ClN2S/c13-7-1-2-11(15)10(4-7)12(17-16)5-9-3-8(14)6-18-9/h1-4,6,12,17H,5,16H2
InChIKeyCSAZGYHDKNDABJ-UHFFFAOYSA-N
XLogP4.67
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.56
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine?
The IUPAC name of [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine (CID 105299240) is [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine?
The canonical SMILES for [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine is NNC(Cc1cc(Br)cs1)c1cc(Br)ccc1Cl.
What is the InChIKey of [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine?
The InChIKey is CSAZGYHDKNDABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Br2ClN2S/c13-7-1-2-11(15)10(4-7)12(17-16)5-9-3-8(14)6-18-9/h1-4,6,12,17H,5,16H2.
What are the key properties of [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine?
[1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine has a molecular weight of 410.56 g/mol, XLogP of 4.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-2-chlorophenyl)-2-(4-bromothiophen-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105299240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).