Vitas-M small molecule compound

3-(9,10-dimethoxy-5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-[2-(1H-imidazol-4-yl)ethyl]propanamide

Catalog ID
STL496342
SMILES COc1ccc2c(c1OC)C(=O)N1C2N(CCC(=O)NCCc2nc[nH]c2)C(=O)c2c1cccc2

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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 C25H25N5O5 MW 475.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O5/c1-34-19-8-7-17-21(22(19)35-2)25(33)30-18-6-4-3-5-16(18)24(32)29(23(17)30)12-10-20(31)27-11-9-15-13-26-14-28-15/h3-8,13-14,23H,9-12H2,1-2H3,(H,26,28)(H,27,31)
InChIKey
JIZXTPSMGPORLD-UHFFFAOYSA-N
Synonyms
1630840-88-8
1630840888
3(910dimethoxy511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)N(2(1Himidazol4yl)ethyl)propanamide
3(910dimethoxy511dioxo6aHisoindolo(21a)quinazolin6yl)N(2(1Himidazol5yl)ethyl)propanamide
91636966
COc1ccc2c(c1OC)C(=O)N1C2N(CCC(=O)NCCc2nc(nH)c2)C(=O)c2c1cccc2
InChI=1SC25H25N5O5c13419871721(22(19)352)25(33)3018643516(18)24(32)29(23(17)30)121020(31)27119151326142815h38131423H912H212H3(H2628)(H2731)
MFCD28349051
N(2(1Himidazol4yl)ethyl)3(910dimethoxy511dioxoisoindolo(21a)quinazolin6(5H6aH11H)yl)propanamide
ZINC000217673248
ZINC000217673334

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Available files

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