[1-(pyrazin-2-yl)ethylidene]amino 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

[1-(pyrazin-2-yl)ethylidene]amino 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

CAS: 866050-54-6

Formula: C17H13ClN4O3

SMILES: CC(=NOC(=O)C1=C(C)ON=C1C1=C(Cl)C=CC=C1)C1=NC=CN=C1

IUPAC: [1-(pyrazin-2-yl)ethylidene]amino 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

InChI: InChI=1S/C17H13ClN4O3/c1-10(14-9-19-7-8-20-14)21-25-17(23)15-11(2)24-22-16(15)12-5-3-4-6-13(12)18/h3-9H,1-2H3

Composition: C (57.23%), H (3.67%), Cl (9.94%), N (15.70%), O (13.45%)

Molar Mass: 356.77

Atom Count: 38

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	356.067618
Formal Charge	0
FSP3	0.12
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	TYJQMXJTNQFNRR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.58
Topological Polar Surface Area	90.47
Polarizability	35.73
Ring Count	3
Rotatable Bond Count	5

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90%	<2 Days	866050-54-6		$51.35-$86.31$51.35$63.37$86.31