Vitas-M small molecule compound

2-[3-(4-benzylpiperazin-1-yl)-6-oxopyridazin-1(6H)-yl]-N-(4-methoxybenzyl)acetamide

Catalog ID
STK932643
SMILES COc1ccc(cc1)CNC(=O)Cn1nc(ccc1=O)N1CCN(CC1)Cc1ccccc1

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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 C25H29N5O3 MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O3/c1-33-22-9-7-20(8-10-22)17-26-24(31)19-30-25(32)12-11-23(27-30)29-15-13-28(14-16-29)18-21-5-3-2-4-6-21/h2-12H,13-19H2,1H3,(H,26,31)
InChIKey
SPXPICMXVFINDE-UHFFFAOYSA-N
Synonyms
1232793-90-6
1232793906
2(3(4benzylpiperazin1yl)6oxopyridazin1(6H)yl)N(4methoxybenzyl)acetamide
2(3(4benzylpiperazin1yl)6oxopyridazin1yl)N((4methoxyphenyl)methyl)acetamide
COC1=CC=C(C=C1)CNC(=O)CN2C(=O)C=CC(=N2)N3CCN(CC3)CC4=CC=CC=C4
InChI=1SC25H29N5O3c133229720(81022)172624(31)193025(32)121123(2730)29151328(141629)18215324621h212H1319H21H3(H2631)
MFCD18065826
ZINC000044893087
ZINC44893087

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Available files

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