4-Chlorothieno[3,2-c]-pyridine - CAS 27685-94-5
Catalog: |
BB019639 |
Product Name: |
4-Chlorothieno[3,2-c]-pyridine |
CAS: |
27685-94-5 |
Synonyms: |
4-chlorothieno[3,2-c]pyridine |
IUPAC Name: | 4-chlorothieno[3,2-c]pyridine |
Description: | 4-Chlorothieno[3,2-c]-pyridine (CAS# 27685-94-5) is a useful research chemical. |
Molecular Weight: | 169.63 |
Molecular Formula: | C7H4ClNS |
Canonical SMILES: | C1=CN=C(C2=C1SC=C2)Cl |
InChI: | InChI=1S/C7H4ClNS/c8-7-5-2-4-10-6(5)1-3-9-7/h1-4H |
InChI Key: | VFPFMOXMHVQFNR-UHFFFAOYSA-N |
Boiling Point: | 296.5 ℃ at 760 mmHg |
Purity: | 97.0 % |
Density: | 1.435 g/cm3 |
MDL: | MFCD01861830 |
LogP: | 2.94970 |
GHS Hazard Statement: | H301 (88.37%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2021078999-A1 | Plasma kallikrein inhibitors and uses thereof | 20190918 |
WO-2021055621-A1 | Plasma kallikrein inhibitors and uses thereof | 20190918 |
WO-2021032933-A1 | Enzyme inhibitors | 20190821 |
WO-2021032934-A1 | Enzyme inhibitors | 20190821 |
WO-2021032935-A1 | Enzyme inhibitors | 20190821 |
Complexity: | 131 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.9752980 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.9752980 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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