Vitas-M small molecule compound
3-(4-tert-butylphenoxy)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2-(trifluoromethyl)-4H-chromen-4-one
Catalog ID
STL331895
SMILES CN1CCN(CC1)Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc(cc1)C(C)(C)C)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 C26H29F3N2O4 MW 490.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29F3N2O4/c1-25(2,3)16-5-7-17(8-6-16)34-23-21(33)18-9-10-20(32)19(15-31-13-11-30(4)12-14-31)22(18)35-24(23)26(27,28)29/h5-10,32H,11-15H2,1-4H3InChIKey
JIGGCYGJVLLBDQ-UHFFFAOYSA-NSynonyms
302951-25-33(4(tertbutyl)phenoxy)7hydroxy8((4methylpiperazin1yl)methyl)2(trifluoromethyl)4Hchromen4one
3(4(TERTBUTYL)PHENOXY)7HYDROXY8((4METHYLPIPERAZINYL)METHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
3(4tertbutylphenoxy)7hydroxy8((4methylpiperazin1yl)methyl)2(trifluoromethyl)4Hchromen4one
3(4TERTBUTYLPHENOXY)7HYDROXY8((4METHYLPIPERAZIN1YL)METHYL)2(TRIFLUOROMETHYL)CHROMEN4ONE
302951253
CC(C)(C)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN4CCN(CC4)C)O)C(F)(F)F
InChI=1SC26H29F3N2O4c125(23)165717(8616)342321(33)1891020(32)19(1531131130(4)121431)22(18)3524(23)26(2728)29h51032H1115H214H3
MFCD02081448
ZINC000019789752
ZINC19789752
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