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LY 334370 hydrochloride

CAT: 0607-B7267-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-B7267-10Size:10 mg
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Description
5-HT1F receptor agonist
CAS Number
199673-74-0
Product Name Alternative
4-fluoro-N-(3-(1-methylpiperidin-4-yl)-1H-indol-5-yl)benzamide hydrochloride
Field of Research
GPCR G protein 5-HT Receptor
Form
Off-white solid
Solubility
<9.7mg/ml in H2O; <9.7mg/ml in DMSO
Smiles
CN1CCC(C2=CNC3=C2C=C(NC(C4=CC=C(F)C=C4)=O)C=C3)CC1.Cl
Molecular Formula
C21H22FN3O·HCl
Molecular Weight
387.88
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

LY 334370 hydrochloride
CAS Number199673-74-0
PubChem CID19710026
IUPAC Name4-fluoro-N-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]benzamide;hydrochloride
Molecular FormulaC21H23ClFN3O
Molecular Weight387.9
Topological Polar Surface Area48.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count27
Formal Charge0
Complexity486
SMILES
CN1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=O)C4=CC=C(C=C4)F.Cl
InChI
InChI=1S/C21H22FN3O.ClH/c1-25-10-8-14(9-11-25)19-13-23-20-7-6-17(12-18(19)20)24-21(26)15-2-4-16(22)5-3-15;/h2-7,12-14,23H,8-11H2,1H3,(H,24,26);1H
InChIKey
DGPDGAPZTPSHBL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of LY 334370 hydrochloride
CAS: 199673-74-0
CID: 19710026
Formula: C21H23ClFN3O
MW: 387.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight387.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass387.1513682
Monoisotopic Mass387.1513682
Topological Polar Surface Area48.1 Ų
Heavy Atom Count27
Formal Charge0
Complexity486
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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