N-{[4-(2-phenylethoxy)phenyl]methyl}-2-(3-phenylpropoxy)aniline

N-{[4-(2-phenylethoxy)phenyl]methyl}-2-(3-phenylpropoxy)aniline

CAS: 1040688-09-2

Formula: C30H31NO2

SMILES: C(COC1=C(NCC2=CC=C(OCCC3=CC=CC=C3)C=C2)C=CC=C1)CC1=CC=CC=C1

IUPAC: N-{[4-(2-phenylethoxy)phenyl]methyl}-2-(3-phenylpropoxy)aniline

InChI: InChI=1S/C30H31NO2/c1-3-10-25(11-4-1)14-9-22-33-30-16-8-7-15-29(30)31-24-27-17-19-28(20-18-27)32-23-21-26-12-5-2-6-13-26/h1-8,10-13,15-20,31H,9,14,21-24H2

Composition: C (82.35%), H (7.14%), N (3.20%), O (7.31%)

Molar Mass: 437.583

Atom Count: 64

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	437.235479242
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	KWCKOYNONSQQPF-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	137.13
Topological Polar Surface Area	30.49
Polarizability	52.58
Ring Count	4
Rotatable Bond Count	12

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