[1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine

C15H16BrClN2S — CID 105238390

IUPAC[1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine
SMILESNNC(CSc1cccc(Br)c1)Cc1ccccc1Cl
InChIInChI=1S/C15H16BrClN2S/c16-12-5-3-6-14(9-12)20-10-13(19-18)8-11-4-1-2-7-15(11)17/h1-7,9,13,19H,8,10,18H2
InChIKeyBFPOSTNUYUQSEV-UHFFFAOYSA-N
MW371.73 g/mol
LogP4.27
Rot. Bonds6

About [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine

[1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine (PubChem CID 105238390) has the molecular formula C15H16BrClN2S and a molecular weight of 371.73 g/mol. Its IUPAC name is [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine
PubChem CID105238390
Molecular FormulaC15H16BrClN2S
Molecular Weight371.73 g/mol
Exact Mass369.99
IUPAC Name[1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine
SMILESNNC(CSc1cccc(Br)c1)Cc1ccccc1Cl
InChIInChI=1S/C15H16BrClN2S/c16-12-5-3-6-14(9-12)20-10-13(19-18)8-11-4-1-2-7-15(11)17/h1-7,9,13,19H,8,10,18H2
InChIKeyBFPOSTNUYUQSEV-UHFFFAOYSA-N
XLogP4.27
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.73
LogP ≤ 54.27
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-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine
CID 105238384
[1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine
CID 105237678
[1-(3-bromophenyl)sulfanyl-3-(2,5-difluorophenyl)propan-2-yl]hydrazine
CID 105238323
[1-(3-chloro-2-fluorophenyl)-3-phenylsulfanylpropan-2-yl]hydrazine
CID 102867810
[1-(3-bromophenyl)sulfanyl-3-(4-iodophenyl)propan-2-yl]hydrazine
CID 105238369
[1-(3-bromophenyl)sulfanyl-4-ethylhexan-2-yl]hydrazine
CID 105238478
1-(3-bromophenyl)sulfanyl-3-(2,6-dichlorophenyl)-N-methylpropan-2-amine
CID 66159819
1-(3-bromophenyl)sulfanylhexan-2-ylhydrazine
CID 105238265
[1-(3-bromophenyl)sulfanyl-4-ethyloctan-2-yl]hydrazine
CID 105238335
[2-(3-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
CID 105238272
[1-(2-chlorophenyl)sulfanyl-3-(2,4-dichlorophenyl)propan-2-yl]hydrazine
CID 105237715
[1-(3-bromophenyl)sulfanyl-6,6,6-trifluorohexan-2-yl]hydrazine
CID 105238354

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine (CID 105238390) is [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine is NNC(CSc1cccc(Br)c1)Cc1ccccc1Cl.
What is the InChIKey of [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine?
The InChIKey is BFPOSTNUYUQSEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrClN2S/c16-12-5-3-6-14(9-12)20-10-13(19-18)8-11-4-1-2-7-15(11)17/h1-7,9,13,19H,8,10,18H2.
What are the key properties of [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine?
[1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine has a molecular weight of 371.73 g/mol, XLogP of 4.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105238390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).