4H-Pyrido(1,2-a)pyrimidine-3-carboxylic acid, 4-oxo-9-((3-thiazolidinylcarbonyl)thio)-, ethyl ester

Base Information

• Chemical Name: 4H-Pyrido(1,2-a)pyrimidine-3-carboxylic acid, 4-oxo-9-((3-thiazolidinylcarbonyl)thio)-, ethyl ester
• CAS No.: 125209-40-7
• Molecular Formula: C15H15 N3 O4 S2
• Molecular Weight: 365.43
• DSSTox Substance ID: DTXSID50154709
• Wikidata: Q83022013
• Mol file: 125209-40-7.mol

Synonyms:125209-40-7;4H-Pyrido(1,2-a)pyrimidine-3-carboxylic acid, 4-oxo-9-((3-thiazolidinylcarbonyl)thio)-, ethyl ester;ethyl 4-oxo-9-(1,3-thiazolidine-3-carbonylsulfanyl)pyrido[1,2-a]pyrimidine-3-carboxylate;4H-Pyrido(1,2-a)pyrimidine-3-carboxylic acid, 4-oxo-9-((3-thiazolidiny lcarbonyl)thio)-, ethyl ester;SCHEMBL10474425;DTXSID50154709;C15H15N3O4S2;QVYIISQMAVQECY-UHFFFAOYSA-N;C15-H15-N3-O4-S2;LS-134101

Chemical Property of 4H-Pyrido(1,2-a)pyrimidine-3-carboxylic acid, 4-oxo-9-((3-thiazolidinylcarbonyl)thio)-, ethyl ester

Chemical Property:

• Vapor Pressure: 7.52E-13mmHg at 25°C
• Boiling Point: 566.4°Cat760mmHg
• Flash Point: 296.4°C
• PSA: 131.58000
• Density: 1.51g/cm³
• LogP: 2.02750
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 365.05039832
• Heavy Atom Count: 24
• Complexity: 712

Purity/Quality:

4H-PYRIDO(1,2-A)PYRIMIDINE-3-CARBOXYLIC ACID, 4-OXO-9-((3-THIAZOLIDINY LCARBONYL)THIO)-, ETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CN=C2C(=CC=CN2C1=O)SC(=O)N3CCSC3