2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide

C16H14F2N2O2S — CID 7780077

IUPAC2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide
SMILESO=C(CSc1ccccc1F)NNC(=O)Cc1ccccc1F
InChIInChI=1S/C16H14F2N2O2S/c17-12-6-2-1-5-11(12)9-15(21)19-20-16(22)10-23-14-8-4-3-7-13(14)18/h1-8H,9-10H2,(H,19,21)(H,20,22)
InChIKeyYUYARIHIVLQQMA-UHFFFAOYSA-N
MW336.36 g/mol
LogP2.45
Rot. Bonds5

About 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide

2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide (PubChem CID 7780077) has the molecular formula C16H14F2N2O2S and a molecular weight of 336.36 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide
PubChem CID7780077
Molecular FormulaC16H14F2N2O2S
Molecular Weight336.36 g/mol
Exact Mass336.07
IUPAC Name2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide
SMILESO=C(CSc1ccccc1F)NNC(=O)Cc1ccccc1F
InChIInChI=1S/C16H14F2N2O2S/c17-12-6-2-1-5-11(12)9-15(21)19-20-16(22)10-23-14-8-4-3-7-13(14)18/h1-8H,9-10H2,(H,19,21)(H,20,22)
InChIKeyYUYARIHIVLQQMA-UHFFFAOYSA-N
XLogP2.45
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.36
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide?
The IUPAC name of 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide (CID 7780077) is 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide.
What is the SMILES notation for 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide?
The canonical SMILES for 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide is O=C(CSc1ccccc1F)NNC(=O)Cc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide?
The InChIKey is YUYARIHIVLQQMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2O2S/c17-12-6-2-1-5-11(12)9-15(21)19-20-16(22)10-23-14-8-4-3-7-13(14)18/h1-8H,9-10H2,(H,19,21)(H,20,22).
What are the key properties of 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide?
2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide has a molecular weight of 336.36 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N'-[2-(2-fluorophenyl)sulfanylacetyl]acetohydrazide is sourced from PubChem (CID 7780077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).