Vitas-M small molecule compound
4-hydroxy-7-(3-methoxyphenyl)-1-(2-methylpropyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Catalog ID
STL056197
SMILES COc1cccc(c1)C1=NC(c2c(N1)n(CC(C)C)c(=O)nc2O)(C(F)(F)F)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 C19H18F6N4O3 MW 464.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F6N4O3/c1-9(2)8-29-14-12(15(30)27-16(29)31)17(18(20,21)22,19(23,24)25)28-13(26-14)10-5-4-6-11(7-10)32-3/h4-7,9H,8H2,1-3H3,(H,26,28)(H,27,30,31)InChIKey
WUSQUKNNIKUUSM-UHFFFAOYSA-NSynonyms
714205-77-34hydroxy7(3methoxyphenyl)1(2methylpropyl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidin2(1H)one
7(3METHOXYPHENYL)1(2METHYLPROPYL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
714205773
CC(C)CN1C2=C(C(=O)NC1=O)C(N=C(N2)C3=CC(=CC=C3)OC)(C(F)(F)F)C(F)(F)F
InChI=1SC19H18F6N4O3c19(2)8291412(15(30)2716(29)31)17(18(2021)2219(2324)25)2813(2614)1054611(710)323h479H8H213H3(H2628)(H273031)
MFCD05736256
ZINC000001276232
ZINC01276232
ZINC1276232
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