Vitas-M small molecule compound

9-bromo-2-[4-(propan-2-yloxy)phenyl]-5-(4-propoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

Catalog ID
STL257280
SMILES CCCOc1ccc(cc1)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)OC(C)C)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 C28H29BrN2O3 MW 521.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29BrN2O3/c1-4-15-32-22-10-7-20(8-11-22)28-31-26(24-16-21(29)9-14-27(24)34-28)17-25(30-31)19-5-12-23(13-6-19)33-18(2)3/h5-14,16,18,26,28H,4,15,17H2,1-3H3
InChIKey
QRKNSLRKYVQSRR-UHFFFAOYSA-N
Synonyms
384350-49-6
384350496
9bromo2(4(propan2yloxy)phenyl)5(4propoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
9bromo2(4isopropoxyphenyl)5(4propoxyphenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
9BROMO2(4PROPAN2YLOXYPHENYL)5(4PROPOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CCCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)OC(C)C)C5=C(O2)C=CC(=C5)Br
InChI=1SC28H29BrN2O3c1415322210720(81122)283126(241621(29)91427(24)3428)1725(3031)1951223(13619)3318(2)3h51416182628H41517H213H3
MFCD06260236
ZINC000009129619
ZINC000013591685

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Available files

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