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AX-024 hydrochloride 2mg

CAT: 0628-A18332-2Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0628-A18332-2Size:2 mg
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CAS Number
1704801-24-0

Chemical Information

AX-024 hydrochloride
CAS Number1704801-24-0
PubChem CID129909862
IUPAC Name1-[[4-(4-fluorophenyl)-6-methoxy-2H-chromen-3-yl]methyl]pyrrolidine;hydrochloride
Molecular FormulaC21H23ClFNO2
Molecular Weight375.9
Topological Polar Surface Area21.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity480
SMILES
COC1=CC2=C(C=C1)OCC(=C2C3=CC=C(C=C3)F)CN4CCCC4.Cl
InChI
InChI=1S/C21H22FNO2.ClH/c1-24-18-8-9-20-19(12-18)21(15-4-6-17(22)7-5-15)16(14-25-20)13-23-10-2-3-11-23;/h4-9,12H,2-3,10-11,13-14H2,1H3;1H
InChIKey
DGBCIMPGYRVTPD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AX-024 hydrochloride
CAS: 1704801-24-0
CID: 129909862
Formula: C21H23ClFNO2
MW: 375.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight375.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass375.1401348
Monoisotopic Mass375.1401348
Topological Polar Surface Area21.7 Ų
Heavy Atom Count26
Formal Charge0
Complexity480
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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