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Belaperidone

CAT: 0931-T26763-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T26763-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
208661-17-0
Target
5-HT Receptor, Others
Related Pathways
Others, GPCR/G Protein, Neuroscience
Bioactivity
Belaperidone is an antipsychotic drug. It has a clozapine-like receptor profile and affinities for dopamine D (4) and 5-hydroxytryptamine (2A) receptors. LU111995 prolongs the Q-T interval to a limited degree and is not arrhythmogenic over the physiological range of CLs.
Smiles
C(CN1C(=O)C=2C(NC1=O)=CC=CC2)N3C[C@@]4([C@H](C[C@@]4(C3)[H])C5=CC=C(F)C=C5)[H]
Molecular Formula
C22H22FN3O2
Molecular Weight
379.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Belaperidone

Belaperidone is a small molecule drug. Belaperidone has a monoisotopic molecular weight of 379.17 Da.

CAS Number208661-17-0
PubChem CID184841
IUPAC Name3-[2-[(1S,5R,6S)-6-(4-fluorophenyl)-3-azabicyclo[3.2.0]heptan-3-yl]ethyl]-1H-quinazoline-2,4-dione
Molecular FormulaC22H22FN3O2
Molecular Weight379.4
XLogP2.9
Topological Polar Surface Area52.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity621
SMILES
C1[C@@H]2CN(C[C@@H]2[C@H]1C3=CC=C(C=C3)F)CCN4C(=O)C5=CC=CC=C5NC4=O
InChI
InChI=1S/C22H22FN3O2/c23-16-7-5-14(6-8-16)18-11-15-12-25(13-19(15)18)9-10-26-21(27)17-3-1-2-4-20(17)24-22(26)28/h1-8,15,18-19H,9-13H2,(H,24,28)/t15-,18-,19+/m1/s1
InChIKey
XLJWJFKYRFPJSD-LZQZEXGQSA-N
Chemical Structure
2D Structure
2D structure of Belaperidone
CAS: 208661-17-0
CID: 184841
Formula: C22H22FN3O2
MW: 379.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight379.4
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass379.16960512
Monoisotopic Mass379.16960512
Topological Polar Surface Area52.7 Ų
Heavy Atom Count28
Formal Charge0
Complexity621
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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