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Fantridone HCl

CAT: 0931-T31745Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T31745Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
24390-12-3
Target
Others
Related Pathways
Others
Bioactivity
Fantridone HCl is a biochemical.
Smiles
Cl.O=C1C=2C=CC=CC2C=3C=CC=CC3N1CCCN(C)C.O
Molecular Formula
C18H23ClN2O2
Molecular Weight
334.84
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Fantridone Hydrochloride
CAS Number24390-12-3
PubChem CID3032801
IUPAC Name5-[3-(dimethylamino)propyl]phenanthridin-6-one;hydrate;hydrochloride
Molecular FormulaC18H23ClN2O2
Molecular Weight334.8
Topological Polar Surface Area24.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity368
SMILES
CN(C)CCCN1C2=CC=CC=C2C3=CC=CC=C3C1=O.O.Cl
InChI
InChI=1S/C18H20N2O.ClH.H2O/c1-19(2)12-7-13-20-17-11-6-5-9-15(17)14-8-3-4-10-16(14)18(20)21;;/h3-6,8-11H,7,12-13H2,1-2H3;1H;1H2
InChIKey
NYUJOGMUKNKJAT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fantridone Hydrochloride
CAS: 24390-12-3
CID: 3032801
Formula: C18H23ClN2O2
MW: 334.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight334.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass334.1448057
Monoisotopic Mass334.1448057
Topological Polar Surface Area24.6 Ų
Heavy Atom Count23
Formal Charge0
Complexity368
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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CatalogName
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