Vitas-M small molecule compound
2-{4-[9-bromo-2-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenoxy}ethanol
Catalog ID
STK534372
SMILES OCCOc1ccc(cc1)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)OC)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 C25H23BrN2O4 MW 495.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23BrN2O4/c1-30-19-7-2-16(3-8-19)22-15-23-21-14-18(26)6-11-24(21)32-25(28(23)27-22)17-4-9-20(10-5-17)31-13-12-29/h2-11,14,23,25,29H,12-13,15H2,1H3InChIKey
GKPVKNQILMMMHZ-UHFFFAOYSA-NSynonyms
2(4(9bromo2(4methoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)phenoxy)ethanol
2(4(9bromo2(4methoxyphenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)phenoxy)ethanol
2(4(9BROMO2(4METHOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)PHENOXY)ETHANOL
COC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Br)OC3C5=CC=C(C=C5)OCCO
InChI=1SC25H23BrN2O4c130197216(3819)221523211418(26)61124(21)3225(28(23)2722)174920(10517)31131229h21114232529H121315H21H3
MFCD02988012
ZINC000008919051
ZINC000102681397
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