Vitas-M small molecule compound
(4-benzylpiperazin-1-yl)[7-(difluoromethyl)-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone
Catalog ID
STK398587
SMILES COc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)N1CCN(CC1)Cc1ccccc1
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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 C26H25F2N5O2 MW 477.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25F2N5O2/c1-35-20-9-7-19(8-10-20)22-15-23(24(27)28)33-25(30-22)21(16-29-33)26(34)32-13-11-31(12-14-32)17-18-5-3-2-4-6-18/h2-10,15-16,24H,11-14,17H2,1H3InChIKey
VELQXGQJGAMNDK-UHFFFAOYSA-NSynonyms
445229-98-1(4benzylpiperazin1yl)(7(difluoromethyl)5(4methoxyphenyl)pyrazolo(15a)pyrimidin3yl)methanone
445229981
COC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)N4CCN(CC4)CC5=CC=CC=C5
InChI=1SC26H25F2N5O2c135209719(81020)221523(24(27)28)3325(3022)21(162933)26(34)32131131(121432)17185324618h210151624H111417H21H3
MFCD02373404
ZINC000020258318
ZINC20258318
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