Vitas-M small molecule compound
7-hydroxy-3-(3-methoxyphenoxy)-8-(pyrrolidin-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-4-one
Catalog ID
STK600039
SMILES COc1cccc(c1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)CN1CCCC1)O
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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 C22H20F3NO5 MW 435.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3NO5/c1-29-13-5-4-6-14(11-13)30-20-18(28)15-7-8-17(27)16(12-26-9-2-3-10-26)19(15)31-21(20)22(23,24)25/h4-8,11,27H,2-3,9-10,12H2,1H3InChIKey
UQEHTBQDVOGNJQ-UHFFFAOYSA-NSynonyms
848727-84-43(3methoxyphenoxy)4oxo8(pyrrolidin1ium1ylmethyl)2(trifluoromethyl)chromen7olate
7hydroxy3(3methoxyphenoxy)8(pyrrolidin1ylmethyl)2(trifluoromethyl)4Hchromen4one
7HYDROXY3(3METHOXYPHENOXY)8(PYRROLIDIN1YLMETHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
7HYDROXY3(3METHOXYPHENOXY)8(PYRROLIDINYLMETHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
848727844
COC1=CC=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C(NH+)4CCCC4)(O))C(F)(F)F
InChI=1SC22H20F3NO5c1291354614(1113)302018(28)157817(27)16(12269231026)19(15)3121(20)22(2324)25h481127H2391012H21H3
MFCD04193569
ZINC000020442872
ZINC20442872
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