Vitas-M small molecule compound

7'-methoxy-2'-(naphthalen-2-yl)-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]

Catalog ID
STK993402
SMILES COc1cccc2c1OC1(CCN(CC1)C(C)C)N1C2CC(=N1)c1ccc2c(c1)cccc2

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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 C28H31N3O2 MW 441.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O2/c1-19(2)30-15-13-28(14-16-30)31-25(23-9-6-10-26(32-3)27(23)33-28)18-24(29-31)22-12-11-20-7-4-5-8-21(20)17-22/h4-12,17,19,25H,13-16,18H2,1-3H3
InChIKey
ZVILGAXNYAHJKT-UHFFFAOYSA-N
Synonyms
890096-40-9
1isopropyl7methoxy2(naphthalen2yl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
7methoxy2(naphthalen2yl)1(propan2yl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
7METHOXY2NAPHTHALEN2YL1PROPAN2YLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
890096409
CC(C)N1CCC2(CC1)N3C(CC(=N3)C4=CC5=CC=CC=C5C=C4)C6=C(O2)C(=CC=C6)OC
InChI=1SC28H31N3O2c119(2)30151328(141630)3125(23961026(323)27(23)3328)1824(2931)22121120745821(20)1722h412171925H131618H213H3
MFCD18184868
ZINC000009374693
ZINC000013644708

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Available files

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