[4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine

C9H6Cl3N3S — CID 7174069

IUPAC[4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1nc(-c2ccc(Cl)c(Cl)c2Cl)cs1
InChIInChI=1S/C9H6Cl3N3S/c10-5-2-1-4(7(11)8(5)12)6-3-16-9(14-6)15-13/h1-3H,13H2,(H,14,15)
InChIKeyJSXOZDXCLPICNB-UHFFFAOYSA-N
MW294.59 g/mol
LogP4.06
Rot. Bonds2

About [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine

[4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine (PubChem CID 7174069) has the molecular formula C9H6Cl3N3S and a molecular weight of 294.59 g/mol. Its IUPAC name is [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine
PubChem CID7174069
Molecular FormulaC9H6Cl3N3S
Molecular Weight294.59 g/mol
Exact Mass292.93
IUPAC Name[4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine
SMILESNNc1nc(-c2ccc(Cl)c(Cl)c2Cl)cs1
InChIInChI=1S/C9H6Cl3N3S/c10-5-2-1-4(7(11)8(5)12)6-3-16-9(14-6)15-13/h1-3H,13H2,(H,14,15)
InChIKeyJSXOZDXCLPICNB-UHFFFAOYSA-N
XLogP4.06
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.59
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[4-(2,5-dichlorophenyl)-1,3-thiazol-2-yl]hydrazine
CID 7174065
[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazine
CID 7174071
1-[4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]ethanamine
CID 5020525
[4-(5-bromo-2-fluorophenyl)-1,3-thiazol-2-yl]hydrazine
CID 82973465
[4-(5-tert-butyl-2-methylphenyl)-1,3-thiazol-2-yl]hydrazine
CID 39103646
[4-(3-methylthiophen-2-yl)-1,3-thiazol-2-yl]hydrazine
CID 63991302
[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride
CID 90481496
[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]hydrazine
CID 5211248
[2-[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 2-(2,3,4-trichlorophenyl)sulfanylacetate
CID 23738511
4-(2-hydrazinyl-1,3-thiazol-4-yl)benzene-1,2-diol
CID 839872
[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]hydrazine
CID 7174047
4-(4-bromo-2-chlorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 82774650

Frequently Asked Questions

What is the IUPAC name of [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine (CID 7174069) is [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine is NNc1nc(-c2ccc(Cl)c(Cl)c2Cl)cs1.
What is the InChIKey of [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine?
The InChIKey is JSXOZDXCLPICNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6Cl3N3S/c10-5-2-1-4(7(11)8(5)12)6-3-16-9(14-6)15-13/h1-3H,13H2,(H,14,15).
What are the key properties of [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine?
[4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine has a molecular weight of 294.59 g/mol, XLogP of 4.06, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3,4-trichlorophenyl)-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 7174069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).