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Chemical structure of Heterocyclyl carbamate derivative 1

GC31293

Heterocyclyl carbamate derivative 1

Also known as [1-[(3-aminophenyl)methyl]piperidin-4-yl] N-benzhydrylcarbamate

Heterocyclyl carbamate derivative 1 is a heterocyclyl carbamate derivative that may be used for the research of inflammatory and neurological diseases

ChemicalCAS168830-01-1MW415.53FormulaC26H29N3O2
CAS number
168830-01-1
Molecular weight
415.53
Formula
C26H29N3O2
Solubility
Soluble in DMSO
InChIKey
BUXIWTJVINPFPP-UHFFFAOYSA-N
Catalogue number
GC31293
Brand
GLPBIO
Computed properties PubChem CID 9803889 · XLogP 4.5 · TPSA 67.6 Ų · H-bond donors 2
XLogP
4.5
TPSA
67.6 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
31

SMILES C1CN(CCC1OC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC(=CC=C4)N

Computed descriptors from PubChem (CID 9803889), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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