Vitas-M small molecule compound
2-(4-bromophenyl)-5-(4-tert-butylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK952686
SMILES Brc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC2c1ccc(cc1)C(C)(C)C
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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 C26H25BrN2O MW 461.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25BrN2O/c1-26(2,3)19-12-8-18(9-13-19)25-29-23(21-6-4-5-7-24(21)30-25)16-22(28-29)17-10-14-20(27)15-11-17/h4-15,23,25H,16H2,1-3H3InChIKey
CTEQVVGBWICFFQ-UHFFFAOYSA-NSynonyms
2(4bromophenyl)5(4tertbutylphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
2(4BROMOPHENYL)5(4TERTBUTYLPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
6(4(TERTBUTYL)PHENYL)9(4BROMOPHENYL)6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZINE
CC(C)(C)C1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)Br)C5=CC=CC=C5O2
InChI=1SC26H25BrN2Oc126(23)1912818(91319)252923(21645724(21)3025)1622(2829)17101420(27)151117h4152325H16H213H3
MFCD03040296
ZINC000012193084
ZINC000012193097
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