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Flutroline

CAT: 0931-T31830-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T31830-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
70801-02-4
Target
Others
Related Pathways
Others
Bioactivity
Flutroline is a gamma-carboline antipsychotic agent.
Smiles
C(CCC(O)C1=CC=C(F)C=C1)N2CC3=C(N(C=4C3=CC(F)=CC4)C5=CC=C(F)C=C5)CC2
Molecular Formula
C27H25F3N2O
Molecular Weight
450.5
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Flutroline

Flutroline is a member of pyrroles.

CAS Number70801-02-4
PubChem CID51174
IUPAC Name4-[8-fluoro-5-(4-fluorophenyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-2-yl]-1-(4-fluorophenyl)butan-1-ol
Molecular FormulaC27H25F3N2O
Molecular Weight450.5
XLogP5.4
Topological Polar Surface Area28.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity622
SMILES
C1CN(CC2=C1N(C3=C2C=C(C=C3)F)C4=CC=C(C=C4)F)CCCC(C5=CC=C(C=C5)F)O
InChI
InChI=1S/C27H25F3N2O/c28-19-5-3-18(4-6-19)27(33)2-1-14-31-15-13-26-24(17-31)23-16-21(30)9-12-25(23)32(26)22-10-7-20(29)8-11-22/h3-12,16,27,33H,1-2,13-15,17H2
InChIKey
OYGDOCFZQVGFIP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Flutroline
CAS: 70801-02-4
CID: 51174
Formula: C27H25F3N2O
MW: 450.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight450.5
XLogP35.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass450.19189791
Monoisotopic Mass450.19189791
Topological Polar Surface Area28.4 Ų
Heavy Atom Count33
Formal Charge0
Complexity622
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-123139Flutroline

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