(4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide

C17H18N2O3S — CID 95316914

IUPAC(4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide
SMILESCc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2ccco2)c1C
InChIInChI=1S/C17H18N2O3S/c1-11-5-3-6-13(12(11)2)18-16(20)14-9-23-10-19(14)17(21)15-7-4-8-22-15/h3-8,14H,9-10H2,1-2H3,(H,18,20)/t14-/m1/s1
InChIKeySJFGGOUTQXILSO-CQSZACIVSA-N
MW330.41 g/mol
LogP3.05
Rot. Bonds3

About (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide

(4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 95316914) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name(4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide
PubChem CID95316914
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC Name(4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide
SMILESCc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2ccco2)c1C
InChIInChI=1S/C17H18N2O3S/c1-11-5-3-6-13(12(11)2)18-16(20)14-9-23-10-19(14)17(21)15-7-4-8-22-15/h3-8,14H,9-10H2,1-2H3,(H,18,20)/t14-/m1/s1
InChIKeySJFGGOUTQXILSO-CQSZACIVSA-N
XLogP3.05
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-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

N-(3,4-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 3398465
(4R)-N-(2,3-dimethylphenyl)-3-(thiophene-3-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 95317689
(4S)-N-(2,3-dimethylphenyl)-3-(1,2,5-thiadiazole-3-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 95292323
(4S)-N-(2,3-dimethylphenyl)-3-(5-methyl-1H-pyrazole-4-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 125130071
3-(furan-2-carbonyl)-N-(1-phenylethyl)-1,3-thiazolidine-4-carboxamide
CID 4030871
3-[(2,3-dimethylphenyl)carbamoyl]-1,3-thiazolidine-4-carboxylic acid
CID 61200074
[3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone
CID 42745661
(4S)-N-(2,4-dimethylphenyl)-3-(5-methylfuran-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 95298062
(4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 97312987
(4S)-3-benzoyl-N-(2,4-dimethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 97310871
N-(2,3-dimethylphenyl)-3-[4-(furan-2-carbonyl)piperazin-1-yl]propanamide
CID 109030173
N-(2-methylphenyl)-3-(2-thiophen-2-ylacetyl)-1,3-thiazolidine-4-carboxamide
CID 122131672

Frequently Asked Questions

What is the IUPAC name of (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide (CID 95316914) is (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide is Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2ccco2)c1C.
What is the InChIKey of (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is SJFGGOUTQXILSO-CQSZACIVSA-N. The full InChI is InChI=1S/C17H18N2O3S/c1-11-5-3-6-13(12(11)2)18-16(20)14-9-23-10-19(14)17(21)15-7-4-8-22-15/h3-8,14H,9-10H2,1-2H3,(H,18,20)/t14-/m1/s1.
What are the key properties of (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide?
(4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 330.41 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 95316914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).