[1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine

C14H15BrClN3S — CID 105238384

IUPAC[1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine
SMILESNNC(CSc1cccc(Br)c1)Cc1ccncc1Cl
InChIInChI=1S/C14H15BrClN3S/c15-11-2-1-3-13(7-11)20-9-12(19-17)6-10-4-5-18-8-14(10)16/h1-5,7-8,12,19H,6,9,17H2
InChIKeyFTBQNVMJZGLNOT-UHFFFAOYSA-N
MW372.72 g/mol
LogP3.66
Rot. Bonds6

About [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine

[1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine (PubChem CID 105238384) has the molecular formula C14H15BrClN3S and a molecular weight of 372.72 g/mol. Its IUPAC name is [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine
PubChem CID105238384
Molecular FormulaC14H15BrClN3S
Molecular Weight372.72 g/mol
Exact Mass370.99
IUPAC Name[1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine
SMILESNNC(CSc1cccc(Br)c1)Cc1ccncc1Cl
InChIInChI=1S/C14H15BrClN3S/c15-11-2-1-3-13(7-11)20-9-12(19-17)6-10-4-5-18-8-14(10)16/h1-5,7-8,12,19H,6,9,17H2
InChIKeyFTBQNVMJZGLNOT-UHFFFAOYSA-N
XLogP3.66
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.72
LogP ≤ 53.66
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'}

Analyze [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)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-bromophenyl)sulfanyl-3-(2-chlorophenyl)propan-2-yl]hydrazine
CID 105238390
[1-(3-bromophenyl)sulfanyl-3-(2,5-difluorophenyl)propan-2-yl]hydrazine
CID 105238323
[1-(3-bromophenyl)sulfanyl-3-(4-iodophenyl)propan-2-yl]hydrazine
CID 105238369
[1-(3-bromophenyl)sulfanyl-3-(5-ethyl-2-pyridinyl)propan-2-yl]hydrazine
CID 105238322
[1-(3-chloro-4-pyridinyl)-3-pyridin-4-ylpropan-2-yl]hydrazine
CID 105212419
2-(3-bromophenyl)-3-(3-chloro-4-pyridinyl)propan-1-ol
CID 79443451
[1-(4-bromo-2-chlorophenyl)-3-(2-chlorophenyl)sulfanylpropan-2-yl]hydrazine
CID 105237678
1-(3-bromophenyl)sulfanylhexan-2-ylhydrazine
CID 105238265
[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-(2-chlorophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)-N-methylpropan-2-amine
CID 66139956
[1-(3-chloro-4-pyridinyl)-3-(2-methoxyphenyl)propan-2-yl]hydrazine
CID 105205014

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine (CID 105238384) is [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine is NNC(CSc1cccc(Br)c1)Cc1ccncc1Cl.
What is the InChIKey of [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine?
The InChIKey is FTBQNVMJZGLNOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrClN3S/c15-11-2-1-3-13(7-11)20-9-12(19-17)6-10-4-5-18-8-14(10)16/h1-5,7-8,12,19H,6,9,17H2.
What are the key properties of [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine?
[1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine has a molecular weight of 372.72 g/mol, XLogP of 3.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromophenyl)sulfanyl-3-(3-chloro-4-pyridinyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105238384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).