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Seganserin

CAT: 0931-T68141-06Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T68141-06Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
87729-89-3
Target
5-HT Receptor
Related Pathways
GPCR/G Protein, Neuroscience
Purity
0.9971
Bioactivity
Seganserin, a non-selective 5-hydroxytryptamine 2-HT receptor antagonist, reversed the inhibitory effects of fluoxetine and quipazine on luteinizing hormone-induced hyperphagia, depression and nociception, and reversed the antidepressant and analgesic effects induced by fluoxetine and quipazine.
Smiles
C(=C1CCN(CCC=2C(=O)N3C(=NC2C)C=CC=C3)CC1)(C4=CC=C(F)C=C4)C5=CC=C(F)C=C5
Molecular Formula
C29H27F2N3O
Molecular Weight
471.54
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Seganserin

Seganserin is a small molecule drug. The usage of the INN stem '-anserin' in the name indicates that Seganserin is a serotonin receptor antagonist. Seganserin has a monoisotopic molecular weight of 471.21 Da.

CAS Number87729-89-3
PubChem CID71767
IUPAC Name3-[2-[4-[bis(4-fluorophenyl)methylidene]piperidin-1-yl]ethyl]-2-methylpyrido[1,2-a]pyrimidin-4-one
Molecular FormulaC29H27F2N3O
Molecular Weight471.5
XLogP5.1
Topological Polar Surface Area35.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count35
Formal Charge0
Complexity928
SMILES
CC1=C(C(=O)N2C=CC=CC2=N1)CCN3CCC(=C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)CC3
InChI
InChI=1S/C29H27F2N3O/c1-20-26(29(35)34-16-3-2-4-27(34)32-20)15-19-33-17-13-23(14-18-33)28(21-5-9-24(30)10-6-21)22-7-11-25(31)12-8-22/h2-12,16H,13-15,17-19H2,1H3
InChIKey
ZGUPMFYFHHSNFK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Seganserin
CAS: 87729-89-3
CID: 71767
Formula: C29H27F2N3O
MW: 471.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight471.5
XLogP35.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass471.21221882
Monoisotopic Mass471.21221882
Topological Polar Surface Area35.9 Ų
Heavy Atom Count35
Formal Charge0
Complexity928
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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