LD 4202 - CAS 14461-92-8
Catalog: |
BB063836 |
Product Name: |
LD 4202 |
CAS: |
14461-92-8 |
Synonyms: |
2-(Cyclopropylmethylamino)-5-phenyl-2-oxazolin-4-one;2-(Cyclopropylmethylamino)-5-phenyl-4(5H)-oxazolone;N-Methyl Cyclazodone |
IUPAC Name: | 2-[cyclopropyl(methyl)amino]-5-phenyl-1,3-oxazol-4-one |
Description: | LD 4202 is used in the preparation of 2- (N- Methyl- N- cyclopropylamino) - 5- phenyloxazolin- 4- one (I) and 2- cyclopropylimino- 3- methyl- 5- phenyloxazolidin- 4- one (II) which are central nervous system stimulating agents and anorexigenic agents. |
Molecular Weight: | 230.26 |
Molecular Formula: | C13H14N2O2 |
Canonical SMILES: | CN(C1CC1)C2=NC(=O)C(O2)C3=CC=CC=C3 |
InChI: | InChI=1S/C13H14N2O2/c1-15(10-7-8-10)13-14-12(16)11(17-13)9-5-3-2-4-6-9/h2-6,10-11H,7-8H2,1H3 |
InChI Key: | FFWGGFGJVZVGOW-UHFFFAOYSA-N |
References: | Giudicelli, R., et al.: Comptes Rendus des Seances de l'Academie des Sciences, Serie D: Sciences Naturelles, 265, 165-8 (1967). |
Complexity: | 343 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 230.105527694 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 230.105527694 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 41.9Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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