Vitas-M small molecule compound
11-(3-bromo-5-ethoxy-4-hydroxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK018363
SMILES CCOc1cc(cc(c1O)Br)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(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 C23H25BrN2O3 MW 457.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25BrN2O3/c1-4-29-19-10-13(9-14(24)22(19)28)21-20-17(11-23(2,3)12-18(20)27)25-15-7-5-6-8-16(15)26-21/h5-10,21,25-26,28H,4,11-12H2,1-3H3InChIKey
ZHWGMJDUQZGFAC-UHFFFAOYSA-NSynonyms
442641-42-111(3bromo5ethoxy4hydroxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
442641421
6(3bromo5ethoxy4hydroxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2)Br)O
CCOc1cc(cc(c1O)Br)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(C)C
InChI=1SC23H25BrN2O3c1429191013(914(24)22(19)28)212017(1123(23)1218(20)27)2515756816(15)2621h51021252628H41112H213H3
MFCD03371121
STK018363
ZINC000001438888
ZINC000001438889
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