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Chemical structure of 5-HT2 antagonist 1

GC32655

5-HT2 antagonist 1

Also known as 5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-8-hydroxy-1-methyl-7,8-dihydro-6H-pyrrolo[3,2-c]azepin-4-one

5-HT2 antagonist 1 is a potent antagonist of 5-HT2 receptor, with weak α1 adrenoceptor blocking activity

ChemicalCAS191592-09-3MW400.49FormulaC22H29FN4O2
CAS number
191592-09-3
Molecular weight
400.49
Formula
C22H29FN4O2
Solubility
Soluble in DMSO
InChIKey
KBZUFSZQLVRGPR-UHFFFAOYSA-N
Catalogue number
GC32655
Brand
GLPBIO
Computed properties PubChem CID 9952825 · XLogP 1.5 · TPSA 52 Ų · H-bond donors 1
XLogP
1.5
TPSA
52 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
29

SMILES CN1C=CC2=C1C(CCN(C2=O)CCCN3CCN(CC3)C4=CC=C(C=C4)F)O

Computed descriptors from PubChem (CID 9952825), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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