Vitas-M small molecule compound
4-[(4-fluorophenyl)amino]-4-oxo-2-({4-[2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}methyl)butanoic acid
Catalog ID
STL154815
SMILES OC(=O)C(CC(=O)Nc1ccc(cc1)F)CN1CCN(CC1)CCN1CCCC1
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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 C21H31FN4O3 MW 406.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31FN4O3/c22-18-3-5-19(6-4-18)23-20(27)15-17(21(28)29)16-26-13-11-25(12-14-26)10-9-24-7-1-2-8-24/h3-6,17H,1-2,7-16H2,(H,23,27)(H,28,29)InChIKey
VQICTMQFJRNZNR-UHFFFAOYSA-NSynonyms
1324092-10-51324092105
4((4fluorophenyl)amino)4oxo2((4(2(pyrrolidin1yl)ethyl)piperazin1yl)methyl)butanoicacid
4(4fluoroanilino)4oxo2((4(2pyrrolidin1ylethyl)piperazin1yl)methyl)butanoicacid
C1CCN(C1)CCN2CCN(CC2)CC(CC(=O)NC3=CC=C(C=C3)F)C(=O)O
InChI=1SC21H31FN4O3c22183519(6418)2320(27)1517(21(28)29)1626131125(121426)10924712824h3617H12716H2(H2327)(H2829)
MFCD19710437
ZINC000071283563
ZINC000071283564
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