| Weight | 99.093 g/mol |
|---|---|
| Formula | C3H5N3O |
| Hydrogen Acceptors | 4 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 0 |
5-methyl-1,3,4-oxadiazol-2-amine (52838-39-8)
52838-39-8
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- The Identification of a Novel Phosphodiesterase 4 Inhibitor, 1-Ethyl-5-{5-[(4-methyl-1-piperazinyl)methyl]-1,3,4-oxadiazol-2-yl}-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-b]pyridin-4-amine (EPPA-1), with Improved Therapeutic Index using Pica Feeding in Rats as a Measure of Emetogenicity (Journal of Pharmacology and Experimental Therapeutics, 2009)
- Discovery and preclinical studies of 5-isopropyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine (BMS-645737), an in vivo active potent VEGFR-2 inhibitor. (Bioorganic & Medicinal Chemistry Letters, 2008)
- Metabolism of 5-isopropyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(2-methyl-1H- pyrrolo(2,3-b)pyridin-5-yl)pyrrolo(2,1-f)(1,2,4)triazin-4-amine (BMS-645737): Identification of an Unusual N-Acetylglucosamine Conjugate in the Cynomolgus Monkey (Drug Metabolism and Disposition, 2008)
- Structure and conformation of the muscarinic agonists 3-(3-amino-1,2,4-oxadiazol-5-yl)-1-azabicyclo[2.2.2]octane and 1,2,5,6-tetrahydro-1-methyl-3-pyridinecarboxaldehyde oxime and related tertiary amine, quaternary ammonium and sulfonium analogues (Acta Crystallographica Section B-structural Science, 1993)
- A ring-fission/CC bond cleavage reaction with an N-alkyl-N-methyl-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]amine (Tetrahedron, 2002)
- 5-(4-Methylphenyl)-1,3,4-oxadiazol-2-amine (Acta Crystallographica Section E-structure Reports Online, 2012)
-
Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 52838-39-8
-
SMILESCC1=NN=C(O1)N
-
InChIKeyXPXWYVCQCNFIIJ-UHFFFAOYSA-N
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Safety
Alternate Names
Estimated Properties
| Boiling Point | 187.17 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 232.2 C | EPI Suite |
| Density | 1.2 g/cm3 | EPA T.E.S.T. |
| Flash Point | 116.96 C | EPA T.E.S.T. |
| Melting Point | 52.69 C | EPI Suite |
| Water Solubility | 113559 mg/L | EPA T.E.S.T. |
| Water Solubility | 1e+06 mg/L | EPI Suite |
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