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N-tert-butyl-2-(2-ethoxy-4-{[(pyridin-3-ylmethyl)amino]methyl}phenoxy)acetamide

N-tert-butyl-2-(2-ethoxy-4-{[(pyridin-3-ylmethyl)amino]methyl}phenoxy)acetamide

Formula: C21H29N3O3

SMILES: CCOC1=CC(CNCC2=CC=CN=C2)=CC=C1OCC(=O)NC(C)(C)C

IUPAC: N-tert-butyl-2-[2-ethoxy-4-({[(pyridin-3-yl)methyl]amino}methyl)phenoxy]acetamide

InChI: InChI=1S/C21H29N3O3/c1-5-26-19-11-16(12-23-14-17-7-6-10-22-13-17)8-9-18(19)27-15-20(25)24-21(2,3)4/h6-11,13,23H,5,12,14-15H2,1-4H3,(H,24,25)

Composition: C (67.90%), H (7.87%), N (11.31%), O (12.92%)

Molar Mass: 371.481

Atom Count: 56

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 371.220891806
Formal Charge 0
FSP3 0.43
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey ZYXHTNKMTYNPGO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 106.05
Topological Polar Surface Area 72.48
Polarizability 41.52
Ring Count 2
Rotatable Bond Count 10

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H29N3O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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