Vitas-M small molecule compound

ethyl 4-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-2,5-dioxopyrrolidin-1-yl)benzoate

Catalog ID
STK224669
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)NCCCN1CCN(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 C27H34N4O4 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O4/c1-2-35-27(34)22-9-11-23(12-10-22)31-25(32)19-24(26(31)33)28-13-6-14-29-15-17-30(18-16-29)20-21-7-4-3-5-8-21/h3-5,7-12,24,28H,2,6,13-20H2,1H3
InChIKey
KBGUWUKHCQBUTL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)NCCCN3CCN(CC3)CC4=CC=CC=C4
ethyl4(3((3(4benzylpiperazin1yl)propyl)amino)25dioxopyrrolidin1yl)benzoate
ethyl4(3(3(4benzylpiperazin1yl)propylamino)25dioxopyrrolidin1yl)benzoate
InChI=1SC27H34N4O4c123527(34)2291123(121022)3125(32)1924(26(31)33)281361429151730(181629)20217435821h357122428H261320H21H3
MFCD06756475
ZINC000022782341
ZINC000101813787

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Available files

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