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 |
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 |
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 |
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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 |
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 |
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