CTW0415

CTW0415
Identifiers
	IUPAC name (2S,4R)-N-[(2S)-2,3-dihydroxypropyl]-4-phenylpiperidine-2-carboxamide;
CAS Number	2772105-16-3;
PubChem CID	156010013;
ChemSpider	123962189;
ChEMBL	ChEMBL4633717;
E number	{{#property:P628}}
CompTox Dashboard (EPA)	{{#property:P3117}}Lua error in Module:EditAtWikidata at line 29: attempt to index field 'wikibase' (a nil value).;
ECHA InfoCard	{{#property:P2566}}Lua error in Module:EditAtWikidata at line 29: attempt to index field 'wikibase' (a nil value).
Chemical and physical data
Formula	C15H22N2O3
Molar mass	278.352 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES C1CN[C@@H](C[C@@H]1C2=CC=CC=C2)C(=O)NC[C@@H](CO)O;
	InChI InChI=1S/C15H22N2O3/c18-10-13(19)9-17-15(20)14-8-12(6-7-16-14)11-4-2-1-3-5-11/h1-5,12-14,16,18-19H,6-10H2,(H,17,20)/t12-,13+,14+/m1/s1; Key:OQMSTMCQUFBTSL-RDBSUJKOSA-N;

CTW0415 is an experimental drug from the piperidine family, which acts as a selective positive allosteric modulator of the 5-HT_2C receptor, with higher potency than older drugs such as VA012. Structure-activity relationship studies showed that small variations to chain length and side chain substitution could lead to preferential binding for either 5-HT_2C or the related 5-HT_2A receptor, which subsequently led to the discovery of the related 5-HT_2A selective positive allosteric modulator CTW0404.^[1]^[2]^[3]

References

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^ WO 2023/023287, Zhou J, Cunningham KA, Bolinger AA, Anastasio NC, "Novel heterocyclic compounds as serotonin (5-ht) 5-ht2a and 5-ht2c receptor positive allosteric modulators.", published Lua error in Module:Citation/CS1/Configuration at line 2172: attempt to index field '?' (a nil value)., assigned to The Board of Regents of the University of Texas System

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[3] WO 2023/023287, Zhou J, Cunningham KA, Bolinger AA, Anastasio NC, "Novel heterocyclic compounds as serotonin (5-ht) 5-ht2a and 5-ht2c receptor positive allosteric modulators.", published Lua error in Module:Citation/CS1/Configuration at line 2172: attempt to index field '?' (a nil value)., assigned to The Board of Regents of the University of Texas System

[1]

[2]

[3]

Identifiers

IUPAC name (2S,4R)-N-[(2S)-2,3-dihydroxypropyl]-4-phenylpiperidine-2-carboxamide
CAS Number	2772105-16-3
PubChem CID	156010013
ChemSpider	123962189
ChEMBL	ChEMBL4633717
E number	{{#property:P628}}
CompTox Dashboard (EPA)	{{#property:P3117}}Lua error in Module:EditAtWikidata at line 29: attempt to index field 'wikibase' (a nil value).
ECHA InfoCard	{{#property:P2566}}Lua error in Module:EditAtWikidata at line 29: attempt to index field 'wikibase' (a nil value).
Chemical and physical data
Formula	C₁₅H₂₂N₂O₃
Molar mass	278.352 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES C1CN[C@@H](C[C@@H]1C2=CC=CC=C2)C(=O)NC[C@@H](CO)O
InChI InChI=1S/C15H22N2O3/c18-10-13(19)9-17-15(20)14-8-12(6-7-16-14)11-4-2-1-3-5-11/h1-5,12-14,16,18-19H,6-10H2,(H,17,20)/t12-,13+,14+/m1/s1 Key:OQMSTMCQUFBTSL-RDBSUJKOSA-N

CTW0415

References

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