[1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine

C15H15BrCl2N2S — CID 105237678

IUPAC[1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine
SMILESNNC(CSc1ccccc1Cl)Cc1ccc(Br)cc1Cl
InChIInChI=1S/C15H15BrCl2N2S/c16-11-6-5-10(14(18)8-11)7-12(20-19)9-21-15-4-2-1-3-13(15)17/h1-6,8,12,20H,7,9,19H2
InChIKeyPCPZILPGTUAFPQ-UHFFFAOYSA-N
MW406.18 g/mol
LogP4.92
Rot. Bonds6

About [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine

[1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine (PubChem CID 105237678) has the molecular formula C15H15BrCl2N2S and a molecular weight of 406.18 g/mol. Its IUPAC name is [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine
PubChem CID105237678
Molecular FormulaC15H15BrCl2N2S
Molecular Weight406.18 g/mol
Exact Mass403.95
IUPAC Name[1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine
SMILESNNC(CSc1ccccc1Cl)Cc1ccc(Br)cc1Cl
InChIInChI=1S/C15H15BrCl2N2S/c16-11-6-5-10(14(18)8-11)7-12(20-19)9-21-15-4-2-1-3-13(15)17/h1-6,8,12,20H,7,9,19H2
InChIKeyPCPZILPGTUAFPQ-UHFFFAOYSA-N
XLogP4.92
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.18
LogP ≤ 54.92
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-(2-chlorophenyl)sulfanyl-3-(2,4-dichlorophenyl)propan-2-yl]hydrazine
CID 105237715
[1-(2-chloro-4-fluorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine
CID 105237547
[1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine
CID 105238390
3-[3-(2-chlorophenyl)sulfanyl-2-hydrazinylpropyl]pyridin-2-amine
CID 105237744
[1-(3-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine
CID 105237759
[1-(4-bromo-2-chlorophenyl)-3-(2,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105335288
[1-(4-bromo-2-chlorophenyl)-4-methoxybutan-2-yl]hydrazine
CID 105206418
[1-(4-bromo-2-chlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine
CID 105206721
1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine
CID 105335285
[1-(2-chlorophenyl)sulfanyl-3-methoxypropan-2-yl]hydrazine
CID 105237720
[2-(4-bromo-2-chlorophenyl)-1-(3-chloro-2-fluorophenyl)ethyl]hydrazine
CID 105223390
[1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine
CID 105238384

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine?
The IUPAC name of [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine (CID 105237678) is [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine is NNC(CSc1ccccc1Cl)Cc1ccc(Br)cc1Cl.
What is the InChIKey of [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine?
The InChIKey is PCPZILPGTUAFPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrCl2N2S/c16-11-6-5-10(14(18)8-11)7-12(20-19)9-21-15-4-2-1-3-13(15)17/h1-6,8,12,20H,7,9,19H2.
What are the key properties of [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine?
[1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine has a molecular weight of 406.18 g/mol, XLogP of 4.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine is sourced from PubChem (CID 105237678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).