Vitas-M small molecule compound
1'-[(3-methoxyphenyl)carbonyl]-5'-methyl-2'-[(4-methylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL053527
SMILES COc1cccc(c1)C(=O)C1N2c3ccccc3C(=CC2C2(C1C(=O)c1ccc(cc1)C)C(=O)Nc1c2cccc1)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 C36H30N2O4 MW 554.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30N2O4/c1-21-15-17-23(18-16-21)33(39)31-32(34(40)24-9-8-10-25(20-24)42-3)38-29-14-7-4-11-26(29)22(2)19-30(38)36(31)27-12-5-6-13-28(27)37-35(36)41/h4-20,30-32H,1-3H3,(H,37,41)InChIKey
JAAFBTBVLKLPCL-UHFFFAOYSA-NSynonyms
(1S2S3R3aR)1(3methoxybenzoyl)5methyl2(4methylbenzoyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1((3methoxyphenyl)carbonyl)5methyl2((4methylphenyl)carbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
1(3methoxybenzoyl)5methyl2(4methylbenzoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CC1=CC=C(C=C1)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=C(C6=CC=CC=C63)C)C(=O)C7=CC(=CC=C7)OC
COc1cccc(c1)C(=O)(C@H)1N2c3ccccc3C(=C(C@@H)2(C@)2((C@@H)1C(=O)c1ccc(cc1)C)C(=O)Nc1c2cccc1)C
InChI=1SC36H30N2O4c121151723(181621)33(39)3132(34(40)24981025(2024)423)382914741126(29)22(2)1930(38)36(31)2712561328(27)3735(36)41h4203032H13H3(H3741)
MFCD05728036
ZINC000102893297
ZINC000245246121
Check stock
See real-time availability and sample size for STL053527 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.