N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide

C13H14FN3O4S — CID 9088553

IUPACN'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide
SMILESO=C(COc1ccc(F)cc1)NNC(=O)CN1CCSC1=O
InChIInChI=1S/C13H14FN3O4S/c14-9-1-3-10(4-2-9)21-8-12(19)16-15-11(18)7-17-5-6-22-13(17)20/h1-4H,5-8H2,(H,15,18)(H,16,19)
InChIKeyMUUJDBWKBAJQRT-UHFFFAOYSA-N
MW327.34 g/mol
LogP0.52
Rot. Bonds5

About N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide

N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide (PubChem CID 9088553) has the molecular formula C13H14FN3O4S and a molecular weight of 327.34 g/mol. Its IUPAC name is N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide.

Molecular Properties

Compound NameN'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide
PubChem CID9088553
Molecular FormulaC13H14FN3O4S
Molecular Weight327.34 g/mol
Exact Mass327.07
IUPAC NameN'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide
SMILESO=C(COc1ccc(F)cc1)NNC(=O)CN1CCSC1=O
InChIInChI=1S/C13H14FN3O4S/c14-9-1-3-10(4-2-9)21-8-12(19)16-15-11(18)7-17-5-6-22-13(17)20/h1-4H,5-8H2,(H,15,18)(H,16,19)
InChIKeyMUUJDBWKBAJQRT-UHFFFAOYSA-N
XLogP0.52
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide 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'-[2-(4-cyanophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide
CID 9085794
[3-[(4-fluorophenoxy)methyl]-1,2,4-oxadiazol-5-yl]methyl 3-(2-oxo-1,3-thiazolidin-3-yl)propanoate
CID 46544854
N-[4-(4-fluorophenoxy)butyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 32643845
N'-[2-(4-fluorophenoxy)acetyl]-2-(4-oxoquinazolin-3-yl)acetohydrazide
CID 7910774
N'-[2-(2-chlorophenoxy)acetyl]-2-(4-fluorophenoxy)acetohydrazide
CID 2561230
2-(4-fluorophenoxy)-N-(1,3-thiazol-4-ylmethyl)acetamide
CID 49345468
1-(3-chlorophenyl)-3-[[2-(2-oxo-1,3-thiazolidin-3-yl)acetyl]amino]thiourea
CID 9088038
N'-[2-(4-tert-butylphenoxy)acetyl]-2-(2-oxoazepan-1-yl)acetohydrazide
CID 9218948
2-(4-fluorophenoxy)-N-(4-hydroxyphenyl)acetamide
CID 9323790
N'-[2-(4-fluorophenoxy)acetyl]-4-iodobenzohydrazide
CID 27836051
N'-[2-(2-chloro-4-fluorophenoxy)acetyl]-2-(4-fluorophenoxy)acetohydrazide
CID 9428452
N'-(4-fluorophenyl)-2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetohydrazide
CID 71901454

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide?
The IUPAC name of N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide (CID 9088553) is N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide.
What is the SMILES notation for N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide?
The canonical SMILES for N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide is O=C(COc1ccc(F)cc1)NNC(=O)CN1CCSC1=O.
What is the InChIKey of N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide?
The InChIKey is MUUJDBWKBAJQRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FN3O4S/c14-9-1-3-10(4-2-9)21-8-12(19)16-15-11(18)7-17-5-6-22-13(17)20/h1-4H,5-8H2,(H,15,18)(H,16,19).
What are the key properties of N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide?
N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide has a molecular weight of 327.34 g/mol, XLogP of 0.52, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-fluorophenoxy)acetyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetohydrazide is sourced from PubChem (CID 9088553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).