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LF 14

CAT: 0013-GTR19193834-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19193834-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
LF 14
CAS Number
88404-01-7
Smiles
N (C (N (C) C) =O) C=1C (N) =CC=NC1
Molecular Formula
C8H12N4O
Molecular Weight
180.21
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

LF 14

affects mammalian non-myelinated nerve fibers; structure given in first source

CAS Number88404-01-7
PubChem CID145881
IUPAC Name3-(4-amino-3-pyridinyl)-1,1-dimethylurea
Molecular FormulaC8H12N4O
Molecular Weight180.21
XLogP-0.6
Topological Polar Surface Area71.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity183
SMILES
CN(C)C(=O)NC1=C(C=CN=C1)N
InChI
InChI=1S/C8H12N4O/c1-12(2)8(13)11-7-5-10-4-3-6(7)9/h3-5H,1-2H3,(H2,9,10)(H,11,13)
InChIKey
ZGDYCZUBOHHZEE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of LF 14
CAS: 88404-01-7
CID: 145881
Formula: C8H12N4O
MW: 180.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight180.21
XLogP3-0.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass180.10111102
Monoisotopic Mass180.10111102
Topological Polar Surface Area71.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity183
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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