Vitas-M small molecule compound
2'-(2,3-dihydro-1,4-benzodioxin-6-yl)-7'-methoxy-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK553682
SMILES COc1cccc2c1OC1(CCN(CC1)C(C)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 C26H31N3O4 MW 449.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O4/c1-17(2)28-11-9-26(10-12-28)29-21(19-5-4-6-23(30-3)25(19)33-26)16-20(27-29)18-7-8-22-24(15-18)32-14-13-31-22/h4-8,15,17,21H,9-14,16H2,1-3H3InChIKey
INFUCCPJKLPGGA-UHFFFAOYSA-NSynonyms
840462-80-82(23dihydro14benzodioxin6yl)7methoxy1(propan2yl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
2(23DIHYDRO14BENZODIOXIN6YL)7METHOXY1PROPAN2YLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
2(23dihydrobenzo(b)(14)dioxin6yl)1isopropyl7methoxy110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
840462808
CC(C)N1CCC2(CC1)N3C(CC(=N3)C4=CC5=C(C=C4)OCCO5)C6=C(O2)C(=CC=C6)OC
InChI=1SC26H31N3O4c117(2)2811926(101228)2921(1954623(303)25(19)3326)1620(2729)18782224(1518)3214133122h48151721H91416H213H3
MFCD04004597
ZINC000009461556
ZINC000009461557
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