6-Methoxypyrido[3,4-d]pyrimidin-4(3H)-one - CAS 183741-98-2
Catalog: |
BB014094 |
Product Name: |
6-Methoxypyrido[3,4-d]pyrimidin-4(3H)-one |
CAS: |
183741-98-2 |
Synonyms: |
6-methoxy-3H-pyrido[3,4-d]pyrimidin-4-one; 6-methoxy-3H-pyrido[3,4-d]pyrimidin-4-one |
IUPAC Name: | 6-methoxy-3H-pyrido[3,4-d]pyrimidin-4-one |
Description: | 6-Methoxypyrido[3,4-d]pyrimidin-4(3H)-one (CAS# 183741-98-2 ) is a useful research chemical. |
Molecular Weight: | 177.16 |
Molecular Formula: | C8H7N3O2 |
Canonical SMILES: | COC1=NC=C2C(=C1)C(=O)NC=N2 |
InChI: | InChI=1S/C8H7N3O2/c1-13-7-2-5-6(3-9-7)10-4-11-8(5)12/h2-4H,1H3,(H,10,11,12) |
InChI Key: | SGPOZFXLPFFDQY-UHFFFAOYSA-N |
LogP: | 0.32670 |
Publication Number | Title | Priority Date |
US-2020354343-A1 | Heterocyclic inhibitors of tyrosine kinase | 20190425 |
WO-2020219904-A1 | Heterocyclic inhibitors of tyrosine kinase | 20190425 |
WO-2019170543-A1 | Identification and use of erk5 inhibitors | 20180307 |
AU-2019232437-A1 | Identification and use of ERK5 inhibitors | 20180307 |
EP-3762379-A1 | Identification and use of erk5 inhibitors | 20180307 |
Complexity: | 242 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.053826475 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.053826475 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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