(4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid

C10H11NO4S2 — CID 81127529

IUPAC(4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid
SMILESCOc1ccsc1C(=O)N1CSC[C@H]1C(=O)O
InChIInChI=1S/C10H11NO4S2/c1-15-7-2-3-17-8(7)9(12)11-5-16-4-6(11)10(13)14/h2-3,6H,4-5H2,1H3,(H,13,14)/t6-/m0/s1
InChIKeyJDXWYLVSNLZTBY-LURJTMIESA-N
MW273.33 g/mol
LogP1.36
Rot. Bonds3

About (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid

(4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid (PubChem CID 81127529) has the molecular formula C10H11NO4S2 and a molecular weight of 273.33 g/mol. Its IUPAC name is (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid.

Molecular Properties

Compound Name(4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid
PubChem CID81127529
Molecular FormulaC10H11NO4S2
Molecular Weight273.33 g/mol
Exact Mass273.01
IUPAC Name(4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid
SMILESCOc1ccsc1C(=O)N1CSC[C@H]1C(=O)O
InChIInChI=1S/C10H11NO4S2/c1-15-7-2-3-17-8(7)9(12)11-5-16-4-6(11)10(13)14/h2-3,6H,4-5H2,1H3,(H,13,14)/t6-/m0/s1
InChIKeyJDXWYLVSNLZTBY-LURJTMIESA-N
XLogP1.36
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4R)-3-(3-ethylthiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 61389230
1-(3-methoxythiophene-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 81117693
(2S)-1-(3-methoxythiophene-2-carbonyl)piperidine-2-carboxylic acid
CID 81126515
(4R)-3-(3,4,5-trimethoxybenzoyl)-1,3-thiazolidine-4-carboxylic acid
CID 53215677
3-(4-bromo-2-methoxybenzoyl)-1,3-thiazolidine-4-carboxylic acid
CID 113295957
3-(2-methoxy-5-nitrobenzoyl)-1,3-thiazolidine-4-carboxylic acid
CID 43359327
(4S)-3-benzoyl-1,3-thiazolidine-4-carboxylic acid
CID 11882190
3-(thieno[3,2-b]thiophene-5-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 80733741
(4R)-3-(3,5-dichloro-4-methoxybenzoyl)-1,3-thiazolidine-4-carboxylic acid
CID 61144844
1-(3-methoxythiophene-2-carbonyl)-N,N-dimethylpiperazine-2-carboxamide
CID 81118721
3-(2,6-difluoro-3-methylbenzoyl)-1,3-thiazolidine-4-carboxylic acid
CID 82814856
3-(5-methoxy-1-methylpyrazole-3-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 114254983

Frequently Asked Questions

What is the IUPAC name of (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid?
The IUPAC name of (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid (CID 81127529) is (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid.
What is the SMILES notation for (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid?
The canonical SMILES for (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid is COc1ccsc1C(=O)N1CSC[C@H]1C(=O)O.
What is the InChIKey of (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid?
The InChIKey is JDXWYLVSNLZTBY-LURJTMIESA-N. The full InChI is InChI=1S/C10H11NO4S2/c1-15-7-2-3-17-8(7)9(12)11-5-16-4-6(11)10(13)14/h2-3,6H,4-5H2,1H3,(H,13,14)/t6-/m0/s1.
What are the key properties of (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid?
(4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid has a molecular weight of 273.33 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-(3-methoxythiophene-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid is sourced from PubChem (CID 81127529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).