[1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine

C13H13BrCl2N2S — CID 105210762

IUPAC[1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine
SMILESNNC(Cc1ccc(Cl)c(Cl)c1)Cc1ccc(Br)s1
InChIInChI=1S/C13H13BrCl2N2S/c14-13-4-2-10(19-13)7-9(18-17)5-8-1-3-11(15)12(16)6-8/h1-4,6,9,18H,5,7,17H2
InChIKeyXNLKXKBDIJAWQB-UHFFFAOYSA-N
MW380.14 g/mol
LogP4.43
Rot. Bonds5

About [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine

[1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine (PubChem CID 105210762) has the molecular formula C13H13BrCl2N2S and a molecular weight of 380.14 g/mol. Its IUPAC name is [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine
PubChem CID105210762
Molecular FormulaC13H13BrCl2N2S
Molecular Weight380.14 g/mol
Exact Mass377.94
IUPAC Name[1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine
SMILESNNC(Cc1ccc(Cl)c(Cl)c1)Cc1ccc(Br)s1
InChIInChI=1S/C13H13BrCl2N2S/c14-13-4-2-10(19-13)7-9(18-17)5-8-1-3-11(15)12(16)6-8/h1-4,6,9,18H,5,7,17H2
InChIKeyXNLKXKBDIJAWQB-UHFFFAOYSA-N
XLogP4.43
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.14
LogP ≤ 54.43
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'}

Analyze [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(3,4-dichlorophenyl)-3-(5-ethylthiophen-2-yl)propan-2-yl]hydrazine
CID 105210859
[1-(5-bromothiophen-2-yl)-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine
CID 105209681
[1-(3,4-dichlorophenyl)-4-methylpentan-2-yl]hydrazine
CID 105198848
[1-(5-bromothiophen-2-yl)-4-methylpentan-2-yl]hydrazine
CID 105198819
3-[3-(3,4-dichlorophenyl)-2-hydrazinylpropyl]pyridin-2-amine
CID 105210921
1-(5-bromothiophen-2-yl)-2-(3,4-dichlorophenyl)ethanamine
CID 55148283
[1-(3-chloro-2-fluorophenyl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine
CID 105264302
[1-(5-bromothiophen-2-yl)-3-(2-fluorophenyl)propan-2-yl]hydrazine
CID 105206828
[1-(5-chlorothiophen-2-yl)-3-naphthalen-2-ylpropan-2-yl]hydrazine
CID 105295964
[1-(3,4-dichlorophenyl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine
CID 105225978
1-(3,4-dichlorophenyl)heptan-2-ylhydrazine
CID 105210910
[1-(5-bromothiophen-2-yl)-4-methylsulfanylbutan-2-yl]hydrazine
CID 105295733

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine (CID 105210762) is [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine is NNC(Cc1ccc(Cl)c(Cl)c1)Cc1ccc(Br)s1.
What is the InChIKey of [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine?
The InChIKey is XNLKXKBDIJAWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrCl2N2S/c14-13-4-2-10(19-13)7-9(18-17)5-8-1-3-11(15)12(16)6-8/h1-4,6,9,18H,5,7,17H2.
What are the key properties of [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine?
[1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine has a molecular weight of 380.14 g/mol, XLogP of 4.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromothiophen-2-yl)-3-(3,4-dichlorophenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105210762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).