Vitas-M small molecule compound

7-(4-fluorophenyl)-1-(2-methylpropyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione

Catalog ID
STK770054
SMILES Fc1ccc(cc1)C1=NC(c2c(N1)n(CC(C)C)c(=O)[nH]c2=O)(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 C18H15F7N4O2 MW 452.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F7N4O2/c1-8(2)7-29-13-11(14(30)27-15(29)31)16(17(20,21)22,18(23,24)25)28-12(26-13)9-3-5-10(19)6-4-9/h3-6,8H,7H2,1-2H3,(H,26,28)(H,27,30,31)
InChIKey
KSZZUBUPEUCUOC-UHFFFAOYSA-N
Synonyms

7(4fluorophenyl)1(2methylpropyl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidine24(1H3H)dione
7(4FLUOROPHENYL)1(2METHYLPROPYL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
CC(C)CN1C2=C(C(=O)NC1=O)C(N=C(N2)C3=CC=C(C=C3)F)(C(F)(F)F)C(F)(F)F
Fc1ccc(cc1)C1=NC(c2c(N1)n(CC(C)C)c(=O)(nH)c2=O)(C(F)(F)F)C(F)(F)F
InChI=1SC18H15F7N4O2c18(2)7291311(14(30)2715(29)31)16(17(2021)2218(2324)25)2812(2613)93510(19)649h368H7H212H3(H2628)(H273031)
MFCD03764010
ZINC000012401543
ZINC12401543

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Available files

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