1,3-Dihydrothiopheno[3,2-d]pyrimidine-2,4-dione - CAS 16233-51-5

Name: 1,3-Dihydrothiopheno[3,2-d]pyrimidine-2,4-dione
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB011859
Product Name:	1,3-Dihydrothiopheno[3,2-d]pyrimidine-2,4-dione
CAS:	16233-51-5
Synonyms:	1H-thieno[3,2-d]pyrimidine-2,4-dione; 1H-thieno[3,2-d]pyrimidine-2,4-dione

Technical Data

IUPAC Name:	1H-thieno[3,2-d]pyrimidine-2,4-dione
Description:	1,3-Dihydrothiopheno[3,2-d]pyrimidine-2,4-dione (CAS# 16233-51-5) is an analog of thieno[3,4-d]pyrimidine and can serve as an inhibitor of dipeptidyl peptidase IV, PKD (serine/threonine kinases) as well as take part in the synthesis of antagonists of the humane adenosine A2B receptor.
Molecular Weight:	168.17
Molecular Formula:	C6H4N2O2S
Canonical SMILES:	C1=CSC2=C1NC(=O)NC2=O
InChI:	InChI=1S/C6H4N2O2S/c9-5-4-3(1-2-11-4)7-6(10)8-5/h1-2H,(H2,7,8,9,10)
InChI Key:	QAFVXBQPQCSSLI-UHFFFAOYSA-N
Boiling Point:	274.804 °C at 760 mmHg
Density:	1.662 g/cm³
MDL:	MFCD09909655
LogP:	1.10250

Publication Number	Title	Priority Date
WO-2021118929-A1	Compounds for treating familial dysautonomia	20191212
US-2020261455-A1	Inhibitors of mutant family tyrosine-kinases	20171018
US-2016257696-A1	Thieno- and pyrrolopyrimidine analogues as anticancer agents and methods of use thereof	20150302
US-9434742-B1	Thieno- and pyrrolopyrimidine analogues as anticancer agents and methods of use thereof	20150302
US-2015336982-A1	Five-And-Six-Membered Heterocyclic Compound, And Preparation Method, Pharmaceutical Composition And Use Thereof	20130118

Complexity:	219
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	167.99934855
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	167.99934855
Rotatable Bond Count:	0
Topological Polar Surface Area:	86.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5