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WAY-639228

CAT: 0931-T80792-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T80792-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
179051-05-9
Target
Others
Related Pathways
Others
Purity
0.9975
Bioactivity
WAY-639228-A has potential antithrombotic and anticoagulant activity for the study of cerebral thrombosis.
Smiles
O=S(=O)(NC1CCN(CC=2C=CC=CC2)CC1)C=3C=CC=4C=CC=CC4C3
Molecular Formula
C22H24N2O2S
Molecular Weight
380.5
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(1-benzylpiperidin-4-yl)naphthalene-2-sulfonamide
CAS Number179051-05-9
PubChem CID2468004
IUPAC NameN-(1-benzylpiperidin-4-yl)naphthalene-2-sulfonamide
Molecular FormulaC22H24N2O2S
Molecular Weight380.5
XLogP4.2
Topological Polar Surface Area57.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity559
SMILES
C1CN(CCC1NS(=O)(=O)C2=CC3=CC=CC=C3C=C2)CC4=CC=CC=C4
InChI
InChI=1S/C22H24N2O2S/c25-27(26,22-11-10-19-8-4-5-9-20(19)16-22)23-21-12-14-24(15-13-21)17-18-6-2-1-3-7-18/h1-11,16,21,23H,12-15,17H2
InChIKey
OSLZNHQRLFUJOQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(1-benzylpiperidin-4-yl)naphthalene-2-sulfonamide
CAS: 179051-05-9
CID: 2468004
Formula: C22H24N2O2S
MW: 380.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight380.5
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass380.15584919
Monoisotopic Mass380.15584919
Topological Polar Surface Area57.8 Ų
Heavy Atom Count27
Formal Charge0
Complexity559
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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