Vitas-M small molecule compound
2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-3-hydroxy-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STK956398
SMILES COc1ccc(cc1Cn1nc(c(c1C)Br)C)C1Nc2ccccc2C(=O)N1O
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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 C21H21BrN4O3 MW 457.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN4O3/c1-12-19(22)13(2)25(24-12)11-15-10-14(8-9-18(15)29-3)20-23-17-7-5-4-6-16(17)21(27)26(20)28/h4-10,20,23,28H,11H2,1-3H3InChIKey
CDWPYLXWGJOSFV-UHFFFAOYSA-NSynonyms
512814-16-32(3((4bromo35dimethyl1Hpyrazol1yl)methyl)4methoxyphenyl)3hydroxy23dihydroquinazolin4(1H)one
2(3((4BROMO35DIMETHYLPYRAZOL1YL)METHYL)4METHOXYPHENYL)3HYDROXY12DIHYDROQUINAZOLIN4ONE
512814163
CC1=C(C(=NN1CC2=C(C=CC(=C2)C3NC4=CC=CC=C4C(=O)N3O)OC)C)Br
InChI=1SC21H21BrN4O3c11219(22)13(2)25(2412)11151014(8918(15)293)202317754616(17)21(27)26(20)28h410202328H11H213H3
MFCD03466851
ZINC000000651342
ZINC000000651344
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