2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one

C24H17N3O2S — CID 135483358

IUPAC2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one
SMILESO=C(CC1SC(=NN=C2c3ccccc3-c3ccccc32)NC1=O)c1ccccc1
InChIInChI=1S/C24H17N3O2S/c28-20(15-8-2-1-3-9-15)14-21-23(29)25-24(30-21)27-26-22-18-12-6-4-10-16(18)17-11-5-7-13-19(17)22/h1-13,21H,14H2,(H,25,27,29)
InChIKeySTNWWFDJELGPNZ-UHFFFAOYSA-N
MW411.49 g/mol
LogP4.28
Rot. Bonds4

About 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one

2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one (PubChem CID 135483358) has the molecular formula C24H17N3O2S and a molecular weight of 411.49 g/mol. Its IUPAC name is 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one
PubChem CID135483358
Molecular FormulaC24H17N3O2S
Molecular Weight411.49 g/mol
Exact Mass411.10
IUPAC Name2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one
SMILESO=C(CC1SC(=NN=C2c3ccccc3-c3ccccc32)NC1=O)c1ccccc1
InChIInChI=1S/C24H17N3O2S/c28-20(15-8-2-1-3-9-15)14-21-23(29)25-24(30-21)27-26-22-18-12-6-4-10-16(18)17-11-5-7-13-19(17)22/h1-13,21H,14H2,(H,25,27,29)
InChIKeySTNWWFDJELGPNZ-UHFFFAOYSA-N
XLogP4.28
TPSA70.89 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.49
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-[2-(4-chlorophenyl)-2-oxoethyl]-2-(fluoren-9-ylidenehydrazinylidene)-1,3-thiazolidin-4-one
CID 135521991
(5S)-5-phenacyl-1,3-thiazolidine-2,4-dione
CID 7013183
(2E)-5-phenacyl-2-[(Z)-[(Z)-3-phenylprop-2-enylidene]hydrazinylidene]-1,3-thiazolidin-4-one
CID 135754176
(2E)-2-[(E)-1-(4-nitrophenyl)ethylidenehydrazinylidene]-5-phenacyl-1,3-thiazolidin-4-one
CID 135706868
(2E)-2-[[4-(dimethylamino)phenyl]methylidenehydrazinylidene]-5-phenacyl-1,3-thiazolidin-4-one
CID 135907437
(5R)-2-(4-ethoxyphenyl)imino-5-phenacyl-1,3-thiazolidin-4-one
CID 135856685
2-imino-5-phenacyl-1,3-thiazolidin-4-one
CID 138978177
(2Z)-5-[2-(4-methoxyphenyl)-2-oxoethyl]-2-[(E)-[(Z)-2-methyl-3-phenylprop-2-enylidene]hydrazinylidene]-1,3-thiazolidin-4-one
CID 135757284
(2E)-5-[2-(4-bromophenyl)-2-oxoethyl]-2-(cinnamylidenehydrazinylidene)-1,3-thiazolidin-4-one
CID 135626186
(2E)-2-[(E)-[5-(4-fluorophenyl)furan-2-yl]methylidenehydrazinylidene]-5-phenacyl-1,3-thiazolidin-4-one
CID 135711877
(2Z)-2-[(E)-benzylidenehydrazinylidene]-5-[2-(3,4-dimethylphenyl)-2-oxoethyl]-1,3-thiazolidin-4-one
CID 135757222
5-[2-(4-fluorophenyl)-2-oxoethyl]-2-naphthalen-1-ylimino-1,3-thiazolidin-4-one
CID 135706945

Frequently Asked Questions

What is the IUPAC name of 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one?
The IUPAC name of 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one (CID 135483358) is 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one is O=C(CC1SC(=NN=C2c3ccccc3-c3ccccc32)NC1=O)c1ccccc1.
What is the InChIKey of 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one?
The InChIKey is STNWWFDJELGPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17N3O2S/c28-20(15-8-2-1-3-9-15)14-21-23(29)25-24(30-21)27-26-22-18-12-6-4-10-16(18)17-11-5-7-13-19(17)22/h1-13,21H,14H2,(H,25,27,29).
What are the key properties of 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one?
2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one has a molecular weight of 411.49 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoren-9-ylidenehydrazinylidene)-5-phenacyl-1,3-thiazolidin-4-one is sourced from PubChem (CID 135483358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).