3,5-dimethyl 4-(2,4-dichlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

3,5-dimethyl 4-(2,4-dichlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Formula: C15H13Cl2NO4

SMILES: COC(=O)C1=CNC=C(C1C1=CC=C(Cl)C=C1Cl)C(=O)OC

IUPAC: 3,5-dimethyl 4-(2,4-dichlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

InChI: InChI=1S/C15H13Cl2NO4/c1-21-14(19)10-6-18-7-11(15(20)22-2)13(10)9-4-3-8(16)5-12(9)17/h3-7,13,18H,1-2H3

Composition: C (52.65%), H (3.83%), Cl (20.72%), N (4.09%), O (18.70%)

Molar Mass: 342.17

Atom Count: 35

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	341.0221633
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	KAZQGIYUODXOOE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.81
Topological Polar Surface Area	64.63
Polarizability	32.21
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H13Cl2NO4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00