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Boc-NHCH2-Ph-Py-NH2

CAT: 0013-GTR19262375-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19262375-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Boc-NHCH2-Ph-Py-NH2 serves as the linker for PROTACXYD190.
CAS Number
3040121-14-7
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C (OC (C) (C) C) NCC=1C=CC (=CC1) C2=NC=C (N) C=C2
Molecular Formula
C17H21N3O2
Molecular Weight
299.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

tert-butyl N-[[4-(5-amino-2-pyridinyl)phenyl]methyl]carbamate
CAS Number3040121-14-7
PubChem CID178203299
IUPAC Nametert-butyl N-[[4-(5-amino-2-pyridinyl)phenyl]methyl]carbamate
Molecular FormulaC17H21N3O2
Molecular Weight299.37
XLogP2.3
Topological Polar Surface Area77.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge0
Complexity359
SMILES
CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C2=NC=C(C=C2)N
InChI
InChI=1S/C17H21N3O2/c1-17(2,3)22-16(21)20-10-12-4-6-13(7-5-12)15-9-8-14(18)11-19-15/h4-9,11H,10,18H2,1-3H3,(H,20,21)
InChIKey
XNPPYABDYSUJAY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of tert-butyl N-[[4-(5-amino-2-pyridinyl)phenyl]methyl]carbamate
CAS: 3040121-14-7
CID: 178203299
Formula: C17H21N3O2
MW: 299.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight299.37
XLogP32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass299.16337692
Monoisotopic Mass299.16337692
Topological Polar Surface Area77.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity359
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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