Vitas-M small molecule compound

2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-7'-methoxy-1-methyl-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]

Catalog ID
STK554547
SMILES COc1cccc2c1OC1(CCN(CC1)C)N1C2CC(=N1)c1ccc2c(c1)OCCO2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H27N3O4 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O4/c1-26-10-8-24(9-11-26)27-19(17-4-3-5-21(28-2)23(17)31-24)15-18(25-27)16-6-7-20-22(14-16)30-13-12-29-20/h3-7,14,19H,8-13,15H2,1-2H3
InChIKey
NXHGHQPICZLDGO-UHFFFAOYSA-N
Synonyms
840476-26-8
2(23dihydro14benzodioxin6yl)7methoxy1methyl110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
2(23DIHYDRO14BENZODIOXIN6YL)7METHOXY1METHYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
2(23dihydrobenzo(b)(14)dioxin6yl)7methoxy1methyl110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
840476268
CN1CCC2(CC1)N3C(CC(=N3)C4=CC5=C(C=C4)OCCO5)C6=C(O2)C(=CC=C6)OC
InChI=1SC24H27N3O4c12610824(91126)2719(1743521(282)23(17)3124)1518(2527)16672022(1416)3013122920h371419H81315H212H3
MFCD04005909
ZINC000005093698
ZINC000005093701

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.