PD-0298029

PD-0298029
Identifiers
	IUPAC name ethyl 3,6a,11,14-tetrahydro-9-methoxy-2-propyl-3,5-dimethyl-(12H)-isoquino[1,2-b]pyrrolo[3,2-f][1,3]benzoxazine-1-carboxylate;
ChemSpider	26233369 ;
CompTox Dashboard (EPA)	DTXSID701029771 ;
Chemical and physical data
Formula	C27H32N2O4
Molar mass	448.563 g·mol−1
3D model (JSmol)	Interactive image; Interactive image;
	SMILES CCCc1c(c2c(n1C)cc(c3c2CN4CCc5cc(ccc5C4O3)OC)C)C(=O)OCC; ; CCCc1n(C)c5cc(C)c3OC4c2ccc(OC)cc2CCN4Cc3c5c1C(=O)OCC;
	InChI InChI=1S/C27H32N2O4/c1-6-8-21-24(27(30)32-7-2)23-20-15-29-12-11-17-14-18(31-5)9-10-19(17)26(29)33-25(20)16(3)13-22(23)28(21)4/h9-10,13-14,26H,6-8,11-12,15H2,1-5H3 ; Key:MTMZSGQXRVRKSY-UHFFFAOYSA-N ;
	(verify)

PD-0298029 is a drug which acts as a selective antagonist for the muscarinic acetylcholine receptor M₄. It was developed for the treatment of Parkinson's disease, but poor bioavailability and rapid metabolism in animal studies have meant its use is largely limited to in vitro research into the M₄ and other muscarinic receptors.^[1]^[2]^[3]

References

[1]

[2]

[3]

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PD-0298029

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References

Identifiers

IUPAC name ethyl 3,6a,11,14-tetrahydro-9-methoxy-2-propyl-3,5-dimethyl-(12H)-isoquino[1,2-b]pyrrolo[3,2-f][1,3]benzoxazine-1-carboxylate
ChemSpider	26233369^Y
CompTox Dashboard (EPA)	DTXSID701029771
Chemical and physical data
Formula	C₂₇H₃₂N₂O₄
Molar mass	448.563 g·mol⁻¹
3D model (JSmol)	Interactive image Interactive image
SMILES CCCc1c(c2c(n1C)cc(c3c2CN4CCc5cc(ccc5C4O3)OC)C)C(=O)OCC CCCc1n(C)c5cc(C)c3OC4c2ccc(OC)cc2CCN4Cc3c5c1C(=O)OCC
InChI InChI=1S/C27H32N2O4/c1-6-8-21-24(27(30)32-7-2)23-20-15-29-12-11-17-14-18(31-5)9-10-19(17)26(29)33-25(20)16(3)13-22(23)28(21)4/h9-10,13-14,26H,6-8,11-12,15H2,1-5H3^Y Key:MTMZSGQXRVRKSY-UHFFFAOYSA-N^Y
(verify)