N-benzyl-2-(2-bromo-4-formyl-6-methoxyphenoxy)acetamide

N-benzyl-2-(2-bromo-4-formyl-6-methoxyphenoxy)acetamide

CAS: 486994-12-1

Formula: C17H16BrNO4

SMILES: COC1=CC(C=O)=CC(Br)=C1OCC(=O)NCC1=CC=CC=C1

IUPAC: N-benzyl-2-(2-bromo-4-formyl-6-methoxyphenoxy)acetamide

InChI: InChI=1S/C17H16BrNO4/c1-22-15-8-13(10-20)7-14(18)17(15)23-11-16(21)19-9-12-5-3-2-4-6-12/h2-8,10H,9,11H2,1H3,(H,19,21)

Composition: C (53.99%), H (4.26%), Br (21.13%), N (3.70%), O (16.92%)

Molar Mass: 378.222

Atom Count: 39

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	377.026271
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	YNJZHBBKWZVLKG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.61
Topological Polar Surface Area	64.63
Polarizability	34.57
Ring Count	2
Rotatable Bond Count	7

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