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4-({[(benzyloxy)carbonyl]amino}methyl)-1-(tert-butoxycarbonyl)piperidine-4-carboxylic acid

4-({[(benzyloxy)carbonyl]amino}methyl)-1-(tert-butoxycarbonyl)piperidine-4-carboxylic acid

CAS: 1192189-66-4

Formula: C20H28N2O6

SMILES: CC(C)(C)OC(=O)N1CCC(CNC(=O)OCC2=CC=CC=C2)(CC1)C(O)=O

IUPAC: 4-({[(benzyloxy)carbonyl]amino}methyl)-1-[(tert-butoxy)carbonyl]piperidine-4-carboxylic acid

InChI: InChI=1S/C20H28N2O6/c1-19(2,3)28-18(26)22-11-9-20(10-12-22,16(23)24)14-21-17(25)27-13-15-7-5-4-6-8-15/h4-8H,9-14H2,1-3H3,(H,21,25)(H,23,24)

Composition: C (61.21%), H (7.19%), N (7.14%), O (24.46%)

Molar Mass: 392.452

Atom Count: 56

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 392.19473663
Formal Charge 0
FSP3 0.55
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey JGYXGJTYLWHYOY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 101.68
Topological Polar Surface Area 105.17
Polarizability 39.77
Ring Count 2
Rotatable Bond Count 8

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1192189-66-4 $168.97-$692.29$168.97$269.85$448.92$692.29
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