4-Aminothieno[2,3-d]pyrimidine - CAS 14080-56-9

Catalog:	BB009114
Product Name:	4-Aminothieno[2,3-d]pyrimidine
CAS:	14080-56-9
Synonyms:	4-thieno[2,3-d]pyrimidinamine; thieno[2,3-d]pyrimidin-4-amine

Technical Data

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Computed Properties

IUPAC Name:	thieno[2,3-d]pyrimidin-4-amine
Description:	4-Aminothieno[2,3-d]pyrimidine (CAS# 14080-56-9) is a useful research chemical.
Molecular Weight:	151.19
Molecular Formula:	C6H5N3S
Canonical SMILES:	C1=CSC2=NC=NC(=C21)N
InChI:	InChI=1S/C6H5N3S/c7-5-4-1-2-10-6(4)9-3-8-5/h1-3H,(H2,7,8,9)
InChI Key:	DYTQGJLVGDSCLF-UHFFFAOYSA-N
Boiling Point:	346.8 °C at 760 mmHg
Density:	1.485 g/cm³
Storage:	Keep in dark place, Inert atmosphere, Room temperature
LogP:	1.85470

Publication Number	Title	Priority Date
WO-2021113849-A1	Her2+ cancer treatment with populations of natural killer cells comprising a cleavage resistant cd16	20191205
WO-2021016621-A1	Populations of natural killer cells comprising a cd38 chimeric antigen receptor	20190725
CN-112047932-A	Pyrazole spleen tyrosine kinase inhibitor and preparation method and application thereof	20190605
WO-2021002986-A2	Bax inhibitors and uses thereof	20190531
WO-2020180768-A1	Bicyclic heteroaryl compounds and uses thereof	20190301

PMID	Publication Date	Title	Journal
19783433	20091101	Analogs of a 4-aminothieno[2,3-d]pyrimidine lead (QB13) as modulators of P-glycoprotein substrate specificity	Bioorganic & medicinal chemistry letters

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	130
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	151.02041835
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	151.02041835
Rotatable Bond Count:	0
Topological Polar Surface Area:	80
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8