6-(2-Fluoro-3-pyridyl)-9-(2-tetrahydropyranyl)-9H-purine - CAS 1093101-52-0
Catalog: |
BB002436 |
Product Name: |
6-(2-Fluoro-3-pyridyl)-9-(2-tetrahydropyranyl)-9H-purine |
CAS: |
1093101-52-0 |
Synonyms: |
6-(2-fluoro-3-pyridinyl)-9-(2-oxanyl)purine; 6-(2-fluoropyridin-3-yl)-9-(oxan-2-yl)purine |
IUPAC Name: | 6-(2-fluoropyridin-3-yl)-9-(oxan-2-yl)purine |
Description: | 6-(2-Fluoro-3-pyridyl)-9-(2-tetrahydropyranyl)-9H-purine (CAS# 1093101-52-0) is a useful research chemical. |
Molecular Weight: | 299.30 |
Molecular Formula: | C15H14FN5O |
Canonical SMILES: | C1CCOC(C1)N2C=NC3=C(N=CN=C32)C4=C(N=CC=C4)F |
InChI: | InChI=1S/C15H14FN5O/c16-14-10(4-3-6-17-14)12-13-15(19-8-18-12)21(9-20-13)11-5-1-2-7-22-11/h3-4,6,8-9,11H,1-2,5,7H2 |
InChI Key: | PCYYHGNCPXKVGI-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 2.72650 |
Publication Number | Title | Priority Date |
AU-2018311538-A1 | Novel BRaf inhibitors and use thereof for treatment of cutaneous reactions | 20170729 |
US-10927112-B2 | BRaf inhibitors and use thereof for treatment of cutaneous reactions | 20170729 |
US-2021070757-A1 | Braf inhibitors and use thereof for treatment of cutaneous reactions | 20170729 |
AU-2017215928-A1 | Pyridine derivative inhibiting Raf kinase and vascular endothelial growth factor receptor, method for preparing same, pharmaceutical composition containing same, and use thereof | 20160203 |
EP-3412670-A1 | Pyridine derivative inhibiting raf kinase and vascular endothelial growth factor receptor, method for preparing same, pharmaceutical composition containing same, and use thereof | 20160203 |
Complexity: | 387 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 299.11823825 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.11823825 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 65.7 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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