N-(5-amino-2-methoxyphenyl)-4-(2,4-dichlorophenoxy)butanamide

N-(5-amino-2-methoxyphenyl)-4-(2,4-dichlorophenoxy)butanamide

CAS: 1020054-50-5

Formula: C17H18Cl2N2O3

SMILES: COC1=C(NC(=O)CCCOC2=C(Cl)C=C(Cl)C=C2)C=C(N)C=C1

IUPAC: N-(5-amino-2-methoxyphenyl)-4-(2,4-dichlorophenoxy)butanamide

InChI: InChI=1S/C17H18Cl2N2O3/c1-23-16-7-5-12(20)10-14(16)21-17(22)3-2-8-24-15-6-4-11(18)9-13(15)19/h4-7,9-10H,2-3,8,20H2,1H3,(H,21,22)

Composition: C (55.30%), H (4.91%), Cl (19.20%), N (7.59%), O (13.00%)

Molar Mass: 369.24

Atom Count: 42

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	368.0694478
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	WIJDXJNNJGSSES-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	97.11
Topological Polar Surface Area	73.58
Polarizability	36.62
Ring Count	2
Rotatable Bond Count	7

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