Vitas-M small molecule compound
9-bromo-5-[4-(pentyloxy)phenyl]-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK739897
SMILES CCCCCOc1ccc(cc1)C1Oc2ccc(cc2C2N1N=C(C2)c1ccccc1)Br
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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 C27H27BrN2O2 MW 491.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27BrN2O2/c1-2-3-7-16-31-22-13-10-20(11-14-22)27-30-25(23-17-21(28)12-15-26(23)32-27)18-24(29-30)19-8-5-4-6-9-19/h4-6,8-15,17,25,27H,2-3,7,16,18H2,1H3InChIKey
LDAKUXYTFVHLBP-UHFFFAOYSA-NSynonyms
1(2BROMO9PHENYL(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL))4PENTYLOXYBENZENE
9bromo5(4(pentyloxy)phenyl)2phenyl110bdihydropyrazolo(15c)(13)benzoxazine
9bromo5(4(pentyloxy)phenyl)2phenyl510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
9BROMO5(4PENTOXYPHENYL)2PHENYL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CCCCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=CC=C4)C5=C(O2)C=CC(=C5)Br
InChI=1SC27H27BrN2O2c1237163122131020(111422)273025(231721(28)121526(23)3227)1824(2930)198546919h46815172527H2371618H21H3
MFCD02986656
ZINC000012192999
ZINC000012193019
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