2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide

C22H25ClN6O3S — CID 10184828

IUPAC2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide
SMILESO=C(CN1CCN(c2ccc(Cl)cc2)CC1)Nc1n[nH]c2ccc(N3CCCS3(=O)=O)cc12
InChIInChI=1S/C22H25ClN6O3S/c23-16-2-4-17(5-3-16)28-11-9-27(10-12-28)15-21(30)24-22-19-14-18(6-7-20(19)25-26-22)29-8-1-13-33(29,31)32/h2-7,14H,1,8-13,15H2,(H2,24,25,26,30)
InChIKeyKNUZYYMRJNPPCP-UHFFFAOYSA-N
MW489.00 g/mol
LogP2.52
Rot. Bonds5

About 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide

2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide (PubChem CID 10184828) has the molecular formula C22H25ClN6O3S and a molecular weight of 489.00 g/mol. Its IUPAC name is 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide.

Molecular Properties

Compound Name2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide
PubChem CID10184828
Molecular FormulaC22H25ClN6O3S
Molecular Weight489.00 g/mol
Exact Mass488.14
IUPAC Name2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide
SMILESO=C(CN1CCN(c2ccc(Cl)cc2)CC1)Nc1n[nH]c2ccc(N3CCCS3(=O)=O)cc12
InChIInChI=1S/C22H25ClN6O3S/c23-16-2-4-17(5-3-16)28-11-9-27(10-12-28)15-21(30)24-22-19-14-18(6-7-20(19)25-26-22)29-8-1-13-33(29,31)32/h2-7,14H,1,8-13,15H2,(H2,24,25,26,30)
InChIKeyKNUZYYMRJNPPCP-UHFFFAOYSA-N
XLogP2.52
TPSA101.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.00
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide 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-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]-3-phenylpropanamide
CID 10110570
N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]-2-[4-(ethylamino)phenyl]acetamide
CID 10201816
N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]-2-[4-(furan-2-yl)phenyl]acetamide
CID 10160190
N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]-2-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 10142705
2-cyclopentyl-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]-2-phenylacetamide
CID 10203520
N-(2,5-dichlorophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide
CID 7949022
2-(4-benzylpiperazin-1-yl)-N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]acetamide
CID 112824184
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide
CID 5019099
N-(3-chloro-4-fluorophenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide
CID 981650
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(3-methylphenyl)acetamide
CID 6466210
[2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl] 4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoate
CID 24523242
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(2-methylphenyl)acetamide
CID 22198476

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide?
The IUPAC name of 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide (CID 10184828) is 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide.
What is the SMILES notation for 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide?
The canonical SMILES for 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide is O=C(CN1CCN(c2ccc(Cl)cc2)CC1)Nc1n[nH]c2ccc(N3CCCS3(=O)=O)cc12.
What is the InChIKey of 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide?
The InChIKey is KNUZYYMRJNPPCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN6O3S/c23-16-2-4-17(5-3-16)28-11-9-27(10-12-28)15-21(30)24-22-19-14-18(6-7-20(19)25-26-22)29-8-1-13-33(29,31)32/h2-7,14H,1,8-13,15H2,(H2,24,25,26,30).
What are the key properties of 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide?
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide has a molecular weight of 489.00 g/mol, XLogP of 2.52, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-chlorophenyl)piperazin-1-yl]-N-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-1H-indazol-3-yl]acetamide is sourced from PubChem (CID 10184828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).