4-Chloro-5-methoxy-2-(2-tetrahydropyranyl)pyridazin-3(2H)-one - CAS 173206-12-7
Catalog: |
BB012895 |
Product Name: |
4-Chloro-5-methoxy-2-(2-tetrahydropyranyl)pyridazin-3(2H)-one |
CAS: |
173206-12-7 |
Synonyms: |
4-chloro-5-methoxy-2-(2-oxanyl)-3-pyridazinone; 4-chloro-5-methoxy-2-(oxan-2-yl)pyridazin-3-one |
IUPAC Name: | 4-chloro-5-methoxy-2-(oxan-2-yl)pyridazin-3-one |
Description: | 4-Chloro-5-methoxy-2-(2-tetrahydropyranyl)pyridazin-3(2H)-one (CAS# 173206-12-7 ) is a useful research chemical. |
Molecular Weight: | 244.67 |
Molecular Formula: | C10H13ClN2O3 |
Canonical SMILES: | COC1=C(C(=O)N(N=C1)C2CCCCO2)Cl |
InChI: | InChI=1S/C10H13ClN2O3/c1-15-7-6-12-13(10(14)9(7)11)8-4-2-3-5-16-8/h6,8H,2-5H2,1H3 |
InChI Key: | GLUSLLVUVQEDNZ-UHFFFAOYSA-N |
LogP: | 1.60440 |
Publication Number | Title | Priority Date |
AU-2013343104-A1 | Heteroaromatic compounds and their use as dopamine D1 ligands | 20121108 |
CA-2890009-A1 | Heteroaromatic compounds and their use as dopamine d1 ligands | 20121108 |
CA-2890009-C | Heteroaromatic compounds and their use as dopamine d1 ligands | 20121108 |
EP-2917219-B1 | Heteroaromatic compounds and their use as dopamine d1 ligands | 20121108 |
EP-3323821-A1 | Heteroaromatic compounds and their use as dopamine d1 ligands | 20121108 |
Complexity: | 354 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 244.06147 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 244.06147 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 51.1 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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