3-Cyclopropyl-4-(difluoromethyl)-7-methyl-[1,2]oxazolo[5,4-b]pyridin-6-one - CAS 1160246-39-8
Catalog: |
BB042954 |
Product Name: |
3-Cyclopropyl-4-(difluoromethyl)-7-methyl-[1,2]oxazolo[5,4-b]pyridin-6-one |
CAS: |
1160246-39-8 |
Synonyms: |
3-Cyclopropyl-4-(difluoromethyl)-7-methylisoxazolo[5,4-b]pyridin-6(7H)-one; SBB026946; STK510327; ZINC35655637 |
IUPAC Name: | 3-cyclopropyl-4-(difluoromethyl)-7-methyl-[1,2]oxazolo[5,4-b]pyridin-6-one |
Description: | 3-Cyclopropyl-4-(difluoromethyl)-7-methyl-[1,2]oxazolo[5,4-b]pyridin-6-one (CAS# 1160246-39-8 ) is a useful research chemical. |
Molecular Weight: | 240.21 |
Molecular Formula: | C11H10F2N2O2 |
Canonical SMILES: | CN1C(=O)C=C(C2=C1ON=C2C3CC3)C(F)F |
InChI: | InChI=1S/C11H10F2N2O2/c1-15-7(16)4-6(10(12)13)8-9(5-2-3-5)14-17-11(8)15/h4-5,10H,2-3H2,1H3 |
InChI Key: | LLUSNALQSXIGIJ-UHFFFAOYSA-N |
Complexity: | 382 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.07103389 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.07103389 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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