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Naratriptan 10mg

CAT: 0628-A10624-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A10624-10Size:10 mg
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CAS Number
121679-13-8

Chemical Information

Naratriptan

Naratriptan is a member of tryptamines, a sulfonamide and a heteroarylpiperidine. It has a role as a serotonergic agonist and a vasoconstrictor agent.

CAS Number121679-13-8
PubChem CID4440
IUPAC NameN-methyl-2-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]ethanesulfonamide
Molecular FormulaC17H25N3O2S
Molecular Weight335.5
XLogP2
Topological Polar Surface Area73.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity483
SMILES
CNS(=O)(=O)CCC1=CC2=C(C=C1)NC=C2C3CCN(CC3)C
InChI
InChI=1S/C17H25N3O2S/c1-18-23(21,22)10-7-13-3-4-17-15(11-13)16(12-19-17)14-5-8-20(2)9-6-14/h3-4,11-12,14,18-19H,5-10H2,1-2H3
InChIKey
AMKVXSZCKVJAGH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Naratriptan
CAS: 121679-13-8
CID: 4440
Formula: C17H25N3O2S
MW: 335.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight335.5
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass335.16674822
Monoisotopic Mass335.16674822
Topological Polar Surface Area73.6 Ų
Heavy Atom Count23
Formal Charge0
Complexity483
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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