Vitas-M small molecule compound

2'-(pyridin-4-yl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]

Catalog ID
STK993446
SMILES n1ccc(cc1)C1=NN2C(C1)c1ccccc1OC12CCN(CC1)C1CCCc2c1cccc2

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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 C29H30N4O MW 450.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O/c1-2-8-23-21(6-1)7-5-10-26(23)32-18-14-29(15-19-32)33-27(24-9-3-4-11-28(24)34-29)20-25(31-33)22-12-16-30-17-13-22/h1-4,6,8-9,11-13,16-17,26-27H,5,7,10,14-15,18-20H2
InChIKey
XVPXUUXMIRFENY-UHFFFAOYSA-N
Synonyms
862245-13-4
2(pyridin4yl)1(1234tetrahydronaphthalen1yl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
2(pyridin4yl)1(1234tetrahydronaphthalen1yl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
2pyridin4yl1(1234tetrahydronaphthalen1yl)spiro(110bdihydropyrazolo(15c)(13)benzoxazine54piperidine)
862245134
C1CC(C2=CC=CC=C2C1)N3CCC4(CC3)N5C(CC(=N5)C6=CC=NC=C6)C7=CC=CC=C7O4
InChI=1SC29H30N4Oc1282321(61)751026(23)32181429(151932)3327(249341128(24)3429)2025(3133)22121630171322h14689111316172627H571014151820H2
MFCD05698167
ZINC000009292248
ZINC000013811004

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Available files

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