N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide

C7H11N3O2S2 — CID 9373062

IUPACN'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide
SMILESCC(=O)NNC(=O)CSC1=NCCS1
InChIInChI=1S/C7H11N3O2S2/c1-5(11)9-10-6(12)4-14-7-8-2-3-13-7/h2-4H2,1H3,(H,9,11)(H,10,12)
InChIKeyHCFQTGFKWYWUSB-UHFFFAOYSA-N
MW233.32 g/mol
LogP-0.01
Rot. Bonds2

About N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide

N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide (PubChem CID 9373062) has the molecular formula C7H11N3O2S2 and a molecular weight of 233.32 g/mol. Its IUPAC name is N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide.

Molecular Properties

Compound NameN'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide
PubChem CID9373062
Molecular FormulaC7H11N3O2S2
Molecular Weight233.32 g/mol
Exact Mass233.03
IUPAC NameN'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide
SMILESCC(=O)NNC(=O)CSC1=NCCS1
InChIInChI=1S/C7H11N3O2S2/c1-5(11)9-10-6(12)4-14-7-8-2-3-13-7/h2-4H2,1H3,(H,9,11)(H,10,12)
InChIKeyHCFQTGFKWYWUSB-UHFFFAOYSA-N
XLogP-0.01
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide?
The IUPAC name of N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide (CID 9373062) is N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide.
What is the SMILES notation for N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide?
The canonical SMILES for N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide is CC(=O)NNC(=O)CSC1=NCCS1.
What is the InChIKey of N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide?
The InChIKey is HCFQTGFKWYWUSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S2/c1-5(11)9-10-6(12)4-14-7-8-2-3-13-7/h2-4H2,1H3,(H,9,11)(H,10,12).
What are the key properties of N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide?
N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide has a molecular weight of 233.32 g/mol, XLogP of -0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetohydrazide is sourced from PubChem (CID 9373062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).