(2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one

C19H18N4OS — CID 139059273

IUPAC(2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one
SMILESCc1nn(-c2ccccc2)c(N)c1N1C(=O)CS[C@H]1c1ccccc1
InChIInChI=1S/C19H18N4OS/c1-13-17(18(20)23(21-13)15-10-6-3-7-11-15)22-16(24)12-25-19(22)14-8-4-2-5-9-14/h2-11,19H,12,20H2,1H3/t19-/m0/s1
InChIKeyWMNOTDOGDLGDPH-IBGZPJMESA-N
MW350.45 g/mol
LogP3.54
Rot. Bonds3

About (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one

(2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one (PubChem CID 139059273) has the molecular formula C19H18N4OS and a molecular weight of 350.45 g/mol. Its IUPAC name is (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one
PubChem CID139059273
Molecular FormulaC19H18N4OS
Molecular Weight350.45 g/mol
Exact Mass350.12
IUPAC Name(2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one
SMILESCc1nn(-c2ccccc2)c(N)c1N1C(=O)CS[C@H]1c1ccccc1
InChIInChI=1S/C19H18N4OS/c1-13-17(18(20)23(21-13)15-10-6-3-7-11-15)22-16(24)12-25-19(22)14-8-4-2-5-9-14/h2-11,19H,12,20H2,1H3/t19-/m0/s1
InChIKeyWMNOTDOGDLGDPH-IBGZPJMESA-N
XLogP3.54
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.45
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one 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

(2S)-3-[4-[(2S)-4-oxo-2-phenyl-1,3-thiazolidin-3-yl]phenyl]-2-phenyl-1,3-thiazolidin-4-one
CID 1041463
2-phenyl-3-pyridin-3-yl-1,3-thiazolidin-4-one
CID 2731887
2-(4-methylsulfanylphenyl)-3-phenyl-1,3-thiazolidin-4-one
CID 5080347
(2S)-3-(4-ethylphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 95402321
2-(4-methoxyphenyl)-3-phenyl-1,3-thiazolidin-4-one
CID 2839840
3-(4-ethylphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 53497781
2-(3-chlorophenyl)-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,3-thiazolidin-4-one
CID 11842533
(2S)-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 1274924
(2S)-3-(4-phenoxyphenyl)-2-phenyl-1,3-thiazolidin-4-one
CID 6935175
2-(3-aminophenyl)-3-(4-fluorophenyl)-1,3-thiazolidin-4-one
CID 42803978
(2S)-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(6-methoxynaphthalen-2-yl)-1,3-thiazolidin-4-one
CID 27566868
3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(6-methoxynaphthalen-2-yl)-1,3-thiazolidin-4-one
CID 11842542

Frequently Asked Questions

What is the IUPAC name of (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one?
The IUPAC name of (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one (CID 139059273) is (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one.
What is the SMILES notation for (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one?
The canonical SMILES for (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one is Cc1nn(-c2ccccc2)c(N)c1N1C(=O)CS[C@H]1c1ccccc1.
What is the InChIKey of (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one?
The InChIKey is WMNOTDOGDLGDPH-IBGZPJMESA-N. The full InChI is InChI=1S/C19H18N4OS/c1-13-17(18(20)23(21-13)15-10-6-3-7-11-15)22-16(24)12-25-19(22)14-8-4-2-5-9-14/h2-11,19H,12,20H2,1H3/t19-/m0/s1.
What are the key properties of (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one?
(2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one has a molecular weight of 350.45 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-3-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-2-phenyl-1,3-thiazolidin-4-one is sourced from PubChem (CID 139059273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).