[2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine

C14H13BrCl2N2S — CID 105235977

IUPAC[2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine
SMILESNNC(CSc1ccc(Br)cc1)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H13BrCl2N2S/c15-9-4-6-10(7-5-9)20-8-13(19-18)11-2-1-3-12(16)14(11)17/h1-7,13,19H,8,18H2
InChIKeyHADQOARWFCDDLR-UHFFFAOYSA-N
MW392.15 g/mol
LogP5.05
Rot. Bonds5

About [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine

[2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine (PubChem CID 105235977) has the molecular formula C14H13BrCl2N2S and a molecular weight of 392.15 g/mol. Its IUPAC name is [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine
PubChem CID105235977
Molecular FormulaC14H13BrCl2N2S
Molecular Weight392.15 g/mol
Exact Mass389.94
IUPAC Name[2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine
SMILESNNC(CSc1ccc(Br)cc1)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H13BrCl2N2S/c15-9-4-6-10(7-5-9)20-8-13(19-18)11-2-1-3-12(16)14(11)17/h1-7,13,19H,8,18H2
InChIKeyHADQOARWFCDDLR-UHFFFAOYSA-N
XLogP5.05
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.15
LogP ≤ 55.05
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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Related Compounds

[1-(4-bromo-3-chloro-2-fluorophenyl)-2-(4-bromophenyl)sulfanylethyl]hydrazine
CID 106765297
[2-(4-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
CID 105235850
[2-(4-bromophenyl)sulfanyl-1-(4-bromothiophen-3-yl)ethyl]hydrazine
CID 105235884
[2-(4-bromophenyl)sulfanyl-1-(3-ethoxyphenyl)ethyl]hydrazine
CID 105235869
N-(4-bromophenyl)-1-(2,3-dichlorophenyl)ethane-1,2-diamine
CID 65385758
[2-(3-bromophenyl)sulfanyl-1-(2-chloro-5-fluorophenyl)ethyl]hydrazine
CID 105397876
[1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine
CID 105198986
(1-naphthalen-1-yl-2-phenylsulfanylethyl)hydrazine
CID 105228218
[2-(3-bromothiophen-2-yl)-1-(2,3-dichlorophenyl)ethyl]hydrazine
CID 105299508
[1-(2,3-dichlorophenyl)-2-pyridin-4-ylethyl]hydrazine
CID 105212439
2-(4-bromophenyl)sulfanyl-1-(3-chlorophenyl)-N-methylethanamine
CID 66054713
[1-(4-bromothiophen-3-yl)-2-(3-chlorophenyl)sulfanylethyl]hydrazine
CID 105237821

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine (CID 105235977) is [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine is NNC(CSc1ccc(Br)cc1)c1cccc(Cl)c1Cl.
What is the InChIKey of [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine?
The InChIKey is HADQOARWFCDDLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrCl2N2S/c15-9-4-6-10(7-5-9)20-8-13(19-18)11-2-1-3-12(16)14(11)17/h1-7,13,19H,8,18H2.
What are the key properties of [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine?
[2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine has a molecular weight of 392.15 g/mol, XLogP of 5.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromophenyl)sulfanyl-1-(2,3-dichlorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105235977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).