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Compound FL0202

CAT: 0931-FL0202-02Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0931-FL0202-02Size:2 mg
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CAS Number
1332326-40-5
Bioactivity
Compound FL0202, with CAS No. 1332326-40-5, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound FL0202 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
Smiles
CC(C)(C)OC(=O)N1CCC[C@@H]1c1ncc[nH]1
Molecular Formula
C12H19N3O2
Molecular Weight
237.3
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(R)-tert-Butyl 2-(1H-imidazol-2-yl)pyrrolidine-1-carboxylate
CAS Number1332326-40-5
PubChem CID91663891
IUPAC Nametert-butyl (2R)-2-(1H-imidazol-2-yl)pyrrolidine-1-carboxylate
Molecular FormulaC12H19N3O2
Molecular Weight237.30
XLogP1.3
Topological Polar Surface Area58.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity288
SMILES
CC(C)(C)OC(=O)N1CCC[C@@H]1C2=NC=CN2
InChI
InChI=1S/C12H19N3O2/c1-12(2,3)17-11(16)15-8-4-5-9(15)10-13-6-7-14-10/h6-7,9H,4-5,8H2,1-3H3,(H,13,14)/t9-/m1/s1
InChIKey
GHITWFDHFOLATC-SECBINFHSA-N
Chemical Structure
2D Structure
2D structure of (R)-tert-Butyl 2-(1H-imidazol-2-yl)pyrrolidine-1-carboxylate
CAS: 1332326-40-5
CID: 91663891
Formula: C12H19N3O2
MW: 237.30
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight237.30
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass237.147726857
Monoisotopic Mass237.147726857
Topological Polar Surface Area58.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity288
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
FL0200-01Compound FL0200
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FL0072-01Compound FL0072
FL0280-01Compound FL0280
FL0221-01Compound FL0221
FL0290-01Compound FL0290

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