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S-14671

CAT: 0931-T28641-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T28641-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
135722-27-9
Target
5-HT Receptor, Others
Related Pathways
Neuroscience, Others, GPCR/G Protein
Bioactivity
S-14671 is a 5-HT1A receptor agonist (pKi = 9.3) with high efficacy and exceptional in vivo potency. S-14671 also acts as a 5-HT2A and 5-HT2C receptor antagonist (both are pKi = 7.8) .
Smiles
O(C)C1=CC=2C(=CC=CC2C=C1)N3CCN(CCNC(=O)C4=CC=CS4)CC3
Molecular Formula
C22H25N3O2S
Molecular Weight
395.52
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(2-(4-(7-Methoxy-1-naphthalenyl)-1-piperazinyl)ethyl)-2-thiophenecarboxamide

serotonin receptor agonist; RN from toxlit

CAS Number135722-27-9
PubChem CID131907
IUPAC NameN-[2-[4-(7-methoxynaphthalen-1-yl)piperazin-1-yl]ethyl]thiophene-2-carboxamide
Molecular FormulaC22H25N3O2S
Molecular Weight395.5
XLogP4.1
Topological Polar Surface Area73.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity512
SMILES
COC1=CC2=C(C=CC=C2N3CCN(CC3)CCNC(=O)C4=CC=CS4)C=C1
InChI
InChI=1S/C22H25N3O2S/c1-27-18-8-7-17-4-2-5-20(19(17)16-18)25-13-11-24(12-14-25)10-9-23-22(26)21-6-3-15-28-21/h2-8,15-16H,9-14H2,1H3,(H,23,26)
InChIKey
YFNZHCXOYLKDGU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-(4-(7-Methoxy-1-naphthalenyl)-1-piperazinyl)ethyl)-2-thiophenecarboxamide
CAS: 135722-27-9
CID: 131907
Formula: C22H25N3O2S
MW: 395.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight395.5
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass395.16674822
Monoisotopic Mass395.16674822
Topological Polar Surface Area73.1 Ų
Heavy Atom Count28
Formal Charge0
Complexity512
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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