Chemistry:AR-231,453

AR-231,453
Identifiers
	IUPAC name N-(2-fluoro-4-methanesulfonylphenyl)-(6-[4-(3-isopropyl-[1,2,4]oxadiazol-5-yl)-piperidin-1-yl]-5-nitropyrimidin-4-yl)amine;
CAS Number	733750-99-7 ;
PubChem CID	24939268;
IUPHAR/BPS	5653;
ChemSpider	23330691 ;
UNII	07Z1P4981I;
ChEMBL	ChEMBL461384 ;
Chemical and physical data
Formula	C21H24FN7O5S
Molar mass	505.53 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES Fc2cc(S(=O)(C)=O)ccc2Nc1ncnc(c1N(=O)=O)N(CC3)CCC3c(n4)onc4C(C)C;
	InChI InChI=1S/C21H24FN7O5S/c1-12(2)18-26-21(34-27-18)13-6-8-28(9-7-13)20-17(29(30)31)19(23-11-24-20)25-16-5-4-14(10-15(16)22)35(3,32)33/h4-5,10-13H,6-9H2,1-3H3,(H,23,24,25) ; Key:DGBKNTVAKIFYNU-UHFFFAOYSA-N ;
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Short description: Chemical compound

AR-231,453 is an agonist for the suggested novel cannabinoid receptor GPR119.^[1]

References

↑ "Discovery of the first potent and orally efficacious agonist of the orphan G-protein coupled receptor 119.". J Med Chem 51 (17): 5172–5175. 2008. doi:10.1021/jm8006867. PMID 18698756.

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Identifiers

IUPAC name N-(2-fluoro-4-methanesulfonylphenyl)-(6-[4-(3-isopropyl-[1,2,4]oxadiazol-5-yl)-piperidin-1-yl]-5-nitropyrimidin-4-yl)amine
CAS Number	733750-99-7^N
PubChem CID	24939268
IUPHAR/BPS	5653
ChemSpider	23330691^Y
UNII	07Z1P4981I
ChEMBL	ChEMBL461384^Y
Chemical and physical data
Formula	C₂₁H₂₄FN₇O₅S
Molar mass	505.53 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES Fc2cc(S(=O)(C)=O)ccc2Nc1ncnc(c1N(=O)=O)N(CC3)CCC3c(n4)onc4C(C)C
InChI InChI=1S/C21H24FN7O5S/c1-12(2)18-26-21(34-27-18)13-6-8-28(9-7-13)20-17(29(30)31)19(23-11-24-20)25-16-5-4-14(10-15(16)22)35(3,32)33/h4-5,10-13H,6-9H2,1-3H3,(H,23,24,25)^Y Key:DGBKNTVAKIFYNU-UHFFFAOYSA-N^Y
^NY (what is this?) (verify)