Vitas-M small molecule compound

7-(difluoromethyl)-N-[3-(4-fluorophenoxy)-5-nitrophenyl]-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide

Catalog ID
STL399935
SMILES Fc1ccc(cc1)Oc1cc(cc(c1)[N+](=O)[O-])NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1

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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 C26H16F3N5O4 MW 519.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16F3N5O4/c27-16-6-8-19(9-7-16)38-20-11-17(10-18(12-20)34(36)37)31-26(35)21-14-30-33-23(24(28)29)13-22(32-25(21)33)15-4-2-1-3-5-15/h1-14,24H,(H,31,35)
InChIKey
WFYOARJMFCAAAI-UHFFFAOYSA-N
Synonyms
445245-57-8
445245578
7(DIFLUOROMETHYL)N(3(4FLUOROPHENOXY)5NITROPHENYL)5PHENYLPYRAZOLO(15A)PYRIMIDINE3CARBOXAMIDE
C1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)NC4=CC(=CC(=C4)OC5=CC=C(C=C5)F)(N+)(=O)(O)
Fc1ccc(cc1)Oc1cc(cc(c1)(N+)(=O)(O))NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1
InChI=1SC26H16F3N5O4c27166819(9716)38201117(1018(1220)34(36)37)3126(35)2114303323(24(28)29)1322(3225(21)33)154213515h11424H(H3135)
MFCD02243836
ZINC000001005642
ZINC01005642
ZINC1005642

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Available files

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