(4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide

C20H20N4OS — CID 50908401

IUPAC(4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide
SMILESCc1ccc(-c2nn(-c3ccccc3)cc2C2N[C@H](C(N)=O)CS2)cc1
InChIInChI=1S/C20H20N4OS/c1-13-7-9-14(10-8-13)18-16(20-22-17(12-26-20)19(21)25)11-24(23-18)15-5-3-2-4-6-15/h2-11,17,20,22H,12H2,1H3,(H2,21,25)/t17-,20?/m0/s1
InChIKeyOGIHLRJSKZUSKH-DIMJTDRSSA-N
MW364.47 g/mol
LogP3.04
Rot. Bonds4

About (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide

(4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide (PubChem CID 50908401) has the molecular formula C20H20N4OS and a molecular weight of 364.47 g/mol. Its IUPAC name is (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide
PubChem CID50908401
Molecular FormulaC20H20N4OS
Molecular Weight364.47 g/mol
Exact Mass364.14
IUPAC Name(4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide
SMILESCc1ccc(-c2nn(-c3ccccc3)cc2C2N[C@H](C(N)=O)CS2)cc1
InChIInChI=1S/C20H20N4OS/c1-13-7-9-14(10-8-13)18-16(20-22-17(12-26-20)19(21)25)11-24(23-18)15-5-3-2-4-6-15/h2-11,17,20,22H,12H2,1H3,(H2,21,25)/t17-,20?/m0/s1
InChIKeyOGIHLRJSKZUSKH-DIMJTDRSSA-N
XLogP3.04
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide 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

3-(4-methylphenyl)-1-phenylpyrazole-4-carboxamide
CID 2360724
(2S)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-3-[2-[(2S)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-4-oxo-1,3-thiazolidin-3-yl]ethyl]-1,3-thiazolidin-4-one
CID 99654858
ethyl 3,4-dimethyl-6-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate
CID 4037283
1-[5-(4-methylphenyl)-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-3,4-dihydropyrazol-2-yl]ethanone
CID 3653282
3-(4-methylphenyl)-1-phenylpyrazole-4-carbonyl chloride
CID 12965031
1-(4-methylphenyl)-3-phenylpyrazole-4-carboxamide;propanoic acid
CID 175080965
[1-(4-methylphenyl)-3-phenylpyrazol-4-yl]-pyrrolidin-1-ylmethanone
CID 29200834
1-[4-[1-(4-methylphenyl)-3-phenylpyrazole-4-carbonyl]piperazin-1-yl]ethanone
CID 29202210
dimethyl 4-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
CID 988360
3-[5-(4-methylphenyl)-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-3,4-dihydropyrazol-2-yl]benzoic acid
CID 158065196
(1,3-diphenylpyrazol-4-yl)methyl 3-(4-methylphenoxy)propanoate
CID 7703542
(Z)-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]prop-2-enoic acid
CID 2282682

Frequently Asked Questions

What is the IUPAC name of (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide (CID 50908401) is (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide is Cc1ccc(-c2nn(-c3ccccc3)cc2C2N[C@H](C(N)=O)CS2)cc1.
What is the InChIKey of (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is OGIHLRJSKZUSKH-DIMJTDRSSA-N. The full InChI is InChI=1S/C20H20N4OS/c1-13-7-9-14(10-8-13)18-16(20-22-17(12-26-20)19(21)25)11-24(23-18)15-5-3-2-4-6-15/h2-11,17,20,22H,12H2,1H3,(H2,21,25)/t17-,20?/m0/s1.
What are the key properties of (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide?
(4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 364.47 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 50908401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).