methyl 6-amino-5-cyano-4-(2,3-dichlorophenyl)-2-ethyl-4H-pyran-3-carboxylate

methyl 6-amino-5-cyano-4-(2,3-dichlorophenyl)-2-ethyl-4H-pyran-3-carboxylate

Formula: C16H14Cl2N2O3

SMILES: CCC1=C(C(C2=CC=CC(Cl)=C2Cl)C(C#N)=C(N)O1)C(=O)OC

IUPAC: methyl 6-amino-5-cyano-4-(2,3-dichlorophenyl)-2-ethyl-4H-pyran-3-carboxylate

InChI: InChI=1/C16H14Cl2N2O3/c1-3-11-13(16(21)22-2)12(9(7-19)15(20)23-11)8-5-4-6-10(17)14(8)18/h4-6,12H,3,20H2,1-2H3

Composition: C (54.41%), H (4.00%), Cl (20.07%), N (7.93%), O (13.59%)

Molar Mass: 353.2

Atom Count: 37

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	352.0381477
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ZSMPKTJMQPWKCG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.62
Topological Polar Surface Area	85.34
Polarizability	33.82
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H14Cl2N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00