Text Search
Structure Search

({3-bromo-4-[(4-chlorophenyl)methoxy]phenyl}methyl)(pyridin-3-ylmethyl)amine

({3-bromo-4-[(4-chlorophenyl)methoxy]phenyl}methyl)(pyridin-3-ylmethyl)amine

Formula: C20H18BrClN2O

SMILES: ClC1=CC=C(COC2=CC=C(CNCC3=CC=CN=C3)C=C2Br)C=C1

IUPAC: ({3-bromo-4-[(4-chlorophenyl)methoxy]phenyl}methyl)[(pyridin-3-yl)methyl]amine

InChI: InChI=1S/C20H18BrClN2O/c21-19-10-16(11-24-13-17-2-1-9-23-12-17)5-8-20(19)25-14-15-3-6-18(22)7-4-15/h1-10,12,24H,11,13-14H2

Composition: C (57.51%), H (4.34%), Br (19.13%), Cl (8.49%), N (6.71%), O (3.83%)

Molar Mass: 417.73

Atom Count: 43

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 416.029104
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ATKSTJDEASRUTA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 105.27
Topological Polar Surface Area 34.15
Polarizability 40.9
Ring Count 3
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H18BrClN2O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote