Vitas-M small molecule compound
2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1-(7,7,9-trimethyl-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(7H)-yl)ethanone
Catalog ID
STL482653
SMILES CC1=CC(C)(C)N(c2c1cc1OCCOc1c2)C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F
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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 C27H30F3N3O3 MW 501.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30F3N3O3/c1-18-16-26(2,3)33(22-15-24-23(14-21(18)22)35-11-12-36-24)25(34)17-31-7-9-32(10-8-31)20-6-4-5-19(13-20)27(28,29)30/h4-6,13-16H,7-12,17H2,1-3H3InChIKey
AXZQYPXZFFHKJA-UHFFFAOYSA-NSynonyms
2(4(3(trifluoromethyl)phenyl)piperazin1yl)1(779trimethyl23dihydro(14)dioxino(23g)quinolin6(7H)yl)ethanone
2(4(3(trifluoromethyl)phenyl)piperazin1yl)1(779trimethyl23dihydro(14)dioxino(23g)quinolin6yl)ethanone
CC1=CC(N(C2=CC3=C(C=C12)OCCO3)C(=O)CN4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F)(C)C
InChI=1SC27H30F3N3O3c1181626(23)33(22152423(1421(18)22)3511123624)25(34)17317932(10831)2064519(1320)27(2829)30h461316H71217H213H3
MFCD30713358
ZINC000334160317
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