[1-(pyrazin-2-yl)ethylidene]amino 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

[1-(pyrazin-2-yl)ethylidene]amino 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

CAS: 866050-52-4

Formula: C17H12Cl2N4O3

SMILES: CC(=NOC(=O)C1=C(C)ON=C1C1=C(Cl)C=CC=C1Cl)C1=NC=CN=C1

IUPAC: [1-(pyrazin-2-yl)ethylidene]amino 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate

InChI: InChI=1S/C17H12Cl2N4O3/c1-9(13-8-20-6-7-21-13)22-26-17(24)14-10(2)25-23-16(14)15-11(18)4-3-5-12(15)19/h3-8H,1-2H3

Composition: C (52.19%), H (3.09%), Cl (18.12%), N (14.32%), O (12.27%)

Molar Mass: 391.21

Atom Count: 38

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	390.0286457
Formal Charge	0
FSP3	0.12
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	QKSCWBJGCHIALO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.38
Topological Polar Surface Area	90.47
Polarizability	37.67
Ring Count	3
Rotatable Bond Count	4

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90%	<2 Days	866050-52-4		$51.35-$86.31$51.35$63.37$86.31