Vitas-M small molecule compound

(1'R,3R,3'R)-1'-[(4-bromophenyl)carbonyl]-3'-[(4-propylphenyl)carbonyl]-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STK539261
SMILES CCCc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3

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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 C36H29BrN2O3 MW 617.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29BrN2O3/c1-2-7-22-12-14-24(15-13-22)32(40)31-30-21-18-23-8-3-6-11-29(23)39(30)34(33(41)25-16-19-26(37)20-17-25)36(31)27-9-4-5-10-28(27)38-35(36)42/h3-6,8-21,30-31,34H,2,7H2,1H3,(H,38,42)/t30?,31-,34+,36+/m1/s1
InChIKey
AMQFDXBVOHHORT-KBGZEIRRSA-N
Synonyms

(1R3R3R)1((4bromophenyl)carbonyl)3((4propylphenyl)carbonyl)33adihydrospiro(indole32pyrrolo(12a)quinolin)2(1H)one
(1R3R3R)1(4bromobenzoyl)3(4propylbenzoyl)spiro(1Hindole3233adihydro1Hpyrrolo(12a)quinoline)2one
CCCC1=CC=C(C=C1)C(=O)C2C3C=CC4=CC=CC=C4N3C(C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=C(C=C7)Br
CCCc1ccc(cc1)C(=O)(C@H)1C2C=Cc3c(N2(C@H)((C@)21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3
InChI=1SC36H29BrN2O3c12722121424(151322)32(40)31302118238361129(23)39(30)34(33(41)25161926(37)201725)36(31)279451028(27)3835(36)42h36821303134H27H21H3(H3842)t30?3134+36+m1s1
MFCD18241750
ZINC000102424967
ZINC000102424971

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.