N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide

C10H12ClN3O2S — CID 43305113

IUPACN'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide
SMILESCC(=O)NNC(=O)CSc1ccc(N)cc1Cl
InChIInChI=1S/C10H12ClN3O2S/c1-6(15)13-14-10(16)5-17-9-3-2-7(12)4-8(9)11/h2-4H,5,12H2,1H3,(H,13,15)(H,14,16)
InChIKeyUBRZJKBNJVMLKL-UHFFFAOYSA-N
MW273.75 g/mol
LogP1.18
Rot. Bonds3

About N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide

N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide (PubChem CID 43305113) has the molecular formula C10H12ClN3O2S and a molecular weight of 273.75 g/mol. Its IUPAC name is N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide.

Molecular Properties

Compound NameN'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide
PubChem CID43305113
Molecular FormulaC10H12ClN3O2S
Molecular Weight273.75 g/mol
Exact Mass273.03
IUPAC NameN'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide
SMILESCC(=O)NNC(=O)CSc1ccc(N)cc1Cl
InChIInChI=1S/C10H12ClN3O2S/c1-6(15)13-14-10(16)5-17-9-3-2-7(12)4-8(9)11/h2-4H,5,12H2,1H3,(H,13,15)(H,14,16)
InChIKeyUBRZJKBNJVMLKL-UHFFFAOYSA-N
XLogP1.18
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.75
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide 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

N'-acetyl-2-(4-amino-2-methylphenyl)sulfanylacetohydrazide
CID 43302863
2-(4-amino-2-chlorophenyl)sulfanyl-N-(2-methylbutan-2-yl)acetamide
CID 43305275
2-(4-amino-2-chlorophenyl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide
CID 43305339
2-acetamido-3-(4-amino-2-chlorophenyl)sulfanylpropanoic acid
CID 64583287
2-(4-amino-2-chlorophenyl)sulfanyl-N-(propylcarbamoyl)acetamide
CID 43305347
2-(4-amino-2-chlorophenyl)sulfanyl-N-[(4-chlorophenyl)methyl]acetamide
CID 43305259
3-(4-amino-2-chlorophenyl)sulfanyl-N-propan-2-ylpropanamide
CID 62626603
2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide
CID 43305569
2-(4-amino-2-chlorophenyl)sulfanyl-N-(2,6-difluorophenyl)acetamide
CID 43305241
2-(4-amino-2-chlorophenyl)sulfanyl-N-(2,3-dimethylcyclohexyl)acetamide
CID 43305214
2-(4-amino-2-chlorophenyl)sulfanyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 43305123
3-(4-amino-2-chlorophenyl)sulfanyl-N-ethylpropanamide
CID 62324063

Frequently Asked Questions

What is the IUPAC name of N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide?
The IUPAC name of N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide (CID 43305113) is N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide.
What is the SMILES notation for N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide?
The canonical SMILES for N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide is CC(=O)NNC(=O)CSc1ccc(N)cc1Cl.
What is the InChIKey of N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide?
The InChIKey is UBRZJKBNJVMLKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3O2S/c1-6(15)13-14-10(16)5-17-9-3-2-7(12)4-8(9)11/h2-4H,5,12H2,1H3,(H,13,15)(H,14,16).
What are the key properties of N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide?
N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide has a molecular weight of 273.75 g/mol, XLogP of 1.18, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide is sourced from PubChem (CID 43305113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).