[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride

C9H9BrClN3S — CID 90481496

IUPAC[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride
SMILESCl.NNc1nc(-c2ccc(Br)cc2)cs1
InChIInChI=1S/C9H8BrN3S.ClH/c10-7-3-1-6(2-4-7)8-5-14-9(12-8)13-11;/h1-5H,11H2,(H,12,13);1H
InChIKeyKFVCKPLQEUVUIM-UHFFFAOYSA-N
MW306.62 g/mol
LogP3.28
Rot. Bonds2

About [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride

[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride (PubChem CID 90481496) has the molecular formula C9H9BrClN3S and a molecular weight of 306.62 g/mol. Its IUPAC name is [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride.

Molecular Properties

Compound Name[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride
PubChem CID90481496
Molecular FormulaC9H9BrClN3S
Molecular Weight306.62 g/mol
Exact Mass304.94
IUPAC Name[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride
SMILESCl.NNc1nc(-c2ccc(Br)cc2)cs1
InChIInChI=1S/C9H8BrN3S.ClH/c10-7-3-1-6(2-4-7)8-5-14-9(12-8)13-11;/h1-5H,11H2,(H,12,13);1H
InChIKeyKFVCKPLQEUVUIM-UHFFFAOYSA-N
XLogP3.28
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.62
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]hydrazine
CID 5211248
4-(2-hydrazinyl-1,3-thiazol-4-yl)benzoic acid
CID 7174481
[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazine
CID 7174071
4-[4-(4-bromophenyl)phenyl]-1,3-thiazol-2-amine
CID 2756846
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
N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine
CID 3551547
N,N-diethyl-4-(2-hydrazinyl-1,3-thiazol-4-yl)aniline
CID 7148397
[4-(5-bromo-2-fluorophenyl)-1,3-thiazol-2-yl]hydrazine
CID 82973465
4-(4-bromophenyl)-N-(cyclopropylmethyl)-1,3-thiazol-2-amine
CID 59822262
[4-(4-butylphenyl)-1,3-thiazol-2-yl]hydrazine
CID 93188542
[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide
CID 171114823

Frequently Asked Questions

What is the IUPAC name of [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride?
The IUPAC name of [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride (CID 90481496) is [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride.
What is the SMILES notation for [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride?
The canonical SMILES for [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride is Cl.NNc1nc(-c2ccc(Br)cc2)cs1.
What is the InChIKey of [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride?
The InChIKey is KFVCKPLQEUVUIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrN3S.ClH/c10-7-3-1-6(2-4-7)8-5-14-9(12-8)13-11;/h1-5H,11H2,(H,12,13);1H.
What are the key properties of [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride?
[4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride has a molecular weight of 306.62 g/mol, XLogP of 3.28, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-bromophenyl)-1,3-thiazol-2-yl]hydrazine;hydrochloride is sourced from PubChem (CID 90481496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).