Vitas-M small molecule compound

1-cyclooctyl-7-hydroxy-4-[4-(propan-2-yl)phenyl]-1,2-dihydro-3H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-3-one

Catalog ID
STL521280
SMILES Oc1ccc2c(c1)oc1c2nc2c(c1c1ccc(cc1)C(C)C)c(=O)[nH]n2C1CCCCCCC1

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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 C29H31N3O3 MW 469.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O3/c1-17(2)18-10-12-19(13-11-18)24-25-28(30-26-22-15-14-21(33)16-23(22)35-27(24)26)32(31-29(25)34)20-8-6-4-3-5-7-9-20/h10-17,20,33H,3-9H2,1-2H3,(H,31,34)
InChIKey
GWVSQTZBMCFBNT-UHFFFAOYSA-N
Synonyms

1cyclooctyl7hydroxy4(4(propan2yl)phenyl)12dihydro3H(1)benzofuro(32b)pyrazolo(43e)pyridin3one
1cyclooctyl7hydroxy4(4isopropylphenyl)1Hbenzofuro(32b)pyrazolo(43e)pyridin3(2H)one
InChI=1SC29H31N3O3c117(2)18101219(131118)242528(302622151421(33)1623(22)3527(24)26)32(3129(25)34)20864357920h10172033H39H212H3(H3134)
MFCD22574223
Oc1ccc2c(c1)oc1c2nc2c(c1c1ccc(cc1)C(C)C)c(=O)(nH)n2C1CCCCCCC1
ZINC000079188364

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Available files

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