Vitas-M small molecule compound

(5s,7s)-2-(3-bromophenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

Catalog ID
STL512494
SMILES Brc1cccc(c1)C1N2C[C@]3(CN1C[C@@](C2)(C3=O)C(C)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 C20H27BrN2O MW 391.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27BrN2O/c1-13(2)19-9-22-11-20(14(3)4,18(19)24)12-23(10-19)17(22)15-6-5-7-16(21)8-15/h5-8,13-14,17H,9-12H2,1-4H3/t17?,19-,20+
InChIKey
LBTUJFBZKWXWJX-CTXDPNEZSA-N
Synonyms

(1r5R7S)2(3bromophenyl)57diisopropyl13diazaadamantan6one
(5s7s)2(3bromophenyl)57di(propan2yl)13diazatricyclo(3311~37~)decan6one
Brc1cccc(c1)C1N2C(C@)3(CN1C(C@@)(C2)(C3=O)C(C)C)C(C)C
InChI=1SC20H27BrN2Oc113(2)199221120(14(3)418(19)24)1223(1019)17(22)1565716(21)815h58131417H912H214H3t17?1920+
MFCD02924779
ZINC000019320097

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Available files

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