5-Bromomethyl-2-(N,N-ditert-butoxycarbonylamino)PY

HCID 53418448

Basic information

Standard SMILES
CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ccc(CBr)cn1
InChIKey
XDILPCWHUWASTN-UHFFFAOYSA-N
Molecular formula
C16H23BrN2O4
Average molar mass
387.27 g/mol

Names & identifiers

Preferred name
5-Bromomethyl-2-(N,N-ditert-butoxycarbonylamino)PY
IUPAC
tert-butyl N-[5-(bromomethyl)-2-pyridinyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate

Names & synonyms

SCHEMBL20287605-BROMOMETHYL-2-(N,N-DITERT-BUTOXYCARBONYLAMINO)PYXDILPCWHUWASTN-UHFFFAOYSA-Ndi-tert-butyl [5-(bromomethyl)pyridin-2-yl]imidodicarbonate172349-19-8DA-34911di-tert-butyl[5-(bromomethyl)pyridin-2-yl]imidodicarbonate

Database identifiers

PubChem CID
53418448

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
68.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
23

Related reactions

5 records

Compound notes

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