[2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine

C14H19BrN4OS — CID 105290123

IUPAC[2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
SMILESCCCc1nnsc1C(Cc1cc(Br)ccc1OC)NN
InChIInChI=1S/C14H19BrN4OS/c1-3-4-11-14(21-19-18-11)12(17-16)8-9-7-10(15)5-6-13(9)20-2/h5-7,12,17H,3-4,8,16H2,1-2H3
InChIKeyDPJXUJJDQTUUDK-UHFFFAOYSA-N
MW371.30 g/mol
LogP3.01
Rot. Bonds7

About [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine

[2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine (PubChem CID 105290123) has the molecular formula C14H19BrN4OS and a molecular weight of 371.30 g/mol. Its IUPAC name is [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
PubChem CID105290123
Molecular FormulaC14H19BrN4OS
Molecular Weight371.30 g/mol
Exact Mass370.05
IUPAC Name[2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
SMILESCCCc1nnsc1C(Cc1cc(Br)ccc1OC)NN
InChIInChI=1S/C14H19BrN4OS/c1-3-4-11-14(21-19-18-11)12(17-16)8-9-7-10(15)5-6-13(9)20-2/h5-7,12,17H,3-4,8,16H2,1-2H3
InChIKeyDPJXUJJDQTUUDK-UHFFFAOYSA-N
XLogP3.01
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.30
LogP ≤ 53.01
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

[2-(5-bromo-2-methoxyphenyl)-1-(5-bromo-3-pyridinyl)ethyl]hydrazine
CID 105251172
[2-(5-bromo-2-methoxyphenyl)-1-(5-ethylthiophen-2-yl)ethyl]hydrazine
CID 105290102
[2-(5-bromo-2-methoxyphenyl)-1-(3-bromophenyl)ethyl]hydrazine
CID 105198026
[2-(3-bromothiophen-2-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
CID 105299495
[2-(5-bromo-2-methoxyphenyl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261563
[2-(5-bromo-2-methoxyphenyl)-1-(5-chlorofuran-2-yl)ethyl]hydrazine
CID 106694227
[2-(5-bromo-2-methoxyphenyl)-1-(4-iodophenyl)ethyl]hydrazine
CID 105290205
[1-(5-bromofuran-2-yl)-2-(5-bromo-2-methoxyphenyl)ethyl]hydrazine
CID 105290206
[2-(5-bromo-2-methoxyphenyl)-1-(3-methoxyphenyl)ethyl]hydrazine
CID 105191716
[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
CID 105297089
[2-(5-bromo-2-methoxyphenyl)-1-(6-methoxypyrimidin-4-yl)ethyl]hydrazine
CID 102953300
[2-(5-bromo-2-fluorophenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
CID 105294843

Frequently Asked Questions

What is the IUPAC name of [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine (CID 105290123) is [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine is CCCc1nnsc1C(Cc1cc(Br)ccc1OC)NN.
What is the InChIKey of [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine?
The InChIKey is DPJXUJJDQTUUDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN4OS/c1-3-4-11-14(21-19-18-11)12(17-16)8-9-7-10(15)5-6-13(9)20-2/h5-7,12,17H,3-4,8,16H2,1-2H3.
What are the key properties of [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine?
[2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine has a molecular weight of 371.30 g/mol, XLogP of 3.01, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromo-2-methoxyphenyl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105290123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).