Vitas-M small molecule compound

ethyl 4-[7-(3,5-difluorophenyl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]piperazine-1-carboxylate

Catalog ID
STK357038
SMILES CCOC(=O)N1CCN(CC1)c1ncc2c(n1)CC(CC2=O)c1cc(F)cc(c1)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 C21H22F2N4O3 MW 416.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F2N4O3/c1-2-30-21(29)27-5-3-26(4-6-27)20-24-12-17-18(25-20)9-14(10-19(17)28)13-7-15(22)11-16(23)8-13/h7-8,11-12,14H,2-6,9-10H2,1H3
InChIKey
UHZHPXSPTROSQH-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C2=NC=C3C(=N2)CC(CC3=O)C4=CC(=CC(=C4)F)F
ethyl4(7(35difluorophenyl)5oxo5678tetrahydroquinazolin2yl)piperazine1carboxylate
ETHYL4(7(35DIFLUOROPHENYL)5OXO678TRIHYDROQUINAZOLIN2YL)PIPERAZINECARBOXYLATE
ethyl4(7(35difluorophenyl)5oxo78dihydro6Hquinazolin2yl)piperazine1carboxylate
InChI=1SC21H22F2N4O3c123021(29)275326(4627)2024121718(2520)914(1019(17)28)13715(22)1116(23)813h78111214H26910H21H3
MFCD09765983
ZINC000020102035
ZINC000020102038

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.