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

Technical Data

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:	41.9Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2