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Mosapramine hydrochloride

CAT: 0931-T33486-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T33486-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
98043-60-8
Target
Others
Related Pathways
Others
Bioactivity
Mosapramine hydrochloride is a biochemical.
Smiles
O=C1NC2N(C13CCN(CC3)CCCN4C5=C(CCC6=CC=C(C=C64)Cl)C=CC=C5)CCCC2.Cl.Cl
Molecular Formula
C28H37Cl3N4O
Molecular Weight
551.98
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Mosapramine dihydrochloride

Mosapramine dihydrochloride is a racemate comprising equimolar amounts of (R)- and (S)-mosapramine dihydrochloride. It has a role as a dopaminergic antagonist and a second generation antipsychotic.

CAS Number98043-60-8
PubChem CID656595
IUPAC Name1'-[3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]spiro[1,5,6,7,8,8a-hexahydroimidazo[1,2-a]pyridine-3,4'-piperidine]-2-one;dihydrochloride
Molecular FormulaC28H37Cl3N4O
Molecular Weight552.0
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count36
Formal Charge0
Complexity725
SMILES
C1CCN2C(C1)NC(=O)C23CCN(CC3)CCCN4C5=CC=CC=C5CCC6=C4C=C(C=C6)Cl.Cl.Cl
InChI
InChI=1S/C28H35ClN4O.2ClH/c29-23-12-11-22-10-9-21-6-1-2-7-24(21)32(25(22)20-23)16-5-15-31-18-13-28(14-19-31)27(34)30-26-8-3-4-17-33(26)28;;/h1-2,6-7,11-12,20,26H,3-5,8-10,13-19H2,(H,30,34);2*1H
InChIKey
CVCDAZZJQWLXHM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mosapramine dihydrochloride
CAS: 98043-60-8
CID: 656595
Formula: C28H37Cl3N4O
MW: 552.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight552.0
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass550.203295
Monoisotopic Mass550.203295
Topological Polar Surface Area38.8 Ų
Heavy Atom Count36
Formal Charge0
Complexity725
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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