Vitas-M small molecule compound

methyl [1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate

Catalog ID
STL401427
SMILES COC(=O)Cn1cnc2c(c1=O)cnn2c1ccc(cc1)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 C14H11FN4O3 MW 302.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11FN4O3/c1-22-12(20)7-18-8-16-13-11(14(18)21)6-17-19(13)10-4-2-9(15)3-5-10/h2-6,8H,7H2,1H3
InChIKey
BBFKJCDXEQZUMX-UHFFFAOYSA-N
Synonyms
852451-05-9
852451059
COC(=O)CN1C=NC2=C(C1=O)C=NN2C3=CC=C(C=C3)F
InChI=1SC14H11FN4O3c12212(20)7188161311(14(18)21)61719(13)10429(15)3510h268H7H21H3
methyl(1(4fluorophenyl)4oxo14dihydro5Hpyrazolo(34d)pyrimidin5yl)acetate
METHYL2(1(4FLUOROPHENYL)4OXO1HPYRAZOLO(34D)PYRIMIDIN5(4H)YL)ACETATE
METHYL2(1(4FLUOROPHENYL)4OXOPYRAZOLO(34D)PYRIMIDIN5YL)ACETATE
MFCD05715609
ZINC000004475808
ZINC04475808
ZINC4475808

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Available files

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