Vitas-M small molecule compound

2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-(3,4-dimethoxyphenyl)-7,8-dihydroquinazolin-5(6H)-one

Catalog ID
STK210965
SMILES COc1cc(ccc1OC)C1CC(=O)c2c(C1)nc(nc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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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 C28H30N4O5 MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O5/c1-34-24-6-4-19(14-26(24)35-2)20-12-22-21(23(33)13-20)15-29-28(30-22)32-9-7-31(8-10-32)16-18-3-5-25-27(11-18)37-17-36-25/h3-6,11,14-15,20H,7-10,12-13,16-17H2,1-2H3
InChIKey
LCRZFMWJJWBBKN-UHFFFAOYSA-N
Synonyms
777866-61-2
2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)7(34DIMETHOXYPHENYL)78DIHYDRO6HQUINAZOLIN5ONE
2(4(13benzodioxol5ylmethyl)piperazin1yl)7(34dimethoxyphenyl)78dihydroquinazolin5(6H)one
2(4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)7(34DIMETHOXYPHENYL)678TRIHYDROQUINAZOLIN5ONE
2(4(BENZO(D)(13)DIOXOL5YLMETHYL)PIPERAZIN1YL)7(34DIMETHOXYPHENYL)78DIHYDROQUINAZOLIN5(6H)ONE
777866612
COC1=C(C=C(C=C1)C2CC3=NC(=NC=C3C(=O)C2)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6)OC
InChI=1SC28H30N4O5c134246419(1426(24)352)20122221(23(33)1320)152928(3022)329731(81032)1618352527(1118)37173625h3611141520H71012131617H212H3
MFCD06608238
ZINC000019899754
ZINC000019899756

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Available files

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