Vitas-M small molecule compound
4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-hydroxy-7-methyl-2H-chromen-2-one
Catalog ID
STK991682
SMILES Clc1cccc(c1)N1CCN(CC1)Cc1cc(=O)oc2c1cc(O)c(c2)C
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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 C21H21ClN2O3 MW 384.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O3/c1-14-9-20-18(12-19(14)25)15(10-21(26)27-20)13-23-5-7-24(8-6-23)17-4-2-3-16(22)11-17/h2-4,9-12,25H,5-8,13H2,1H3InChIKey
SEHHJMUAQWRYSS-UHFFFAOYSA-NSynonyms
859127-25-64((4(3chlorophenyl)piperazin1ium1yl)methyl)7methyl2oxochromen6olate
4((4(3chlorophenyl)piperazin1yl)methyl)6hydroxy7methyl2Hchromen2one
4((4(3CHLOROPHENYL)PIPERAZIN1YL)METHYL)6HYDROXY7METHYLCHROMEN2ONE
4((4(3CHLOROPHENYL)PIPERAZINYL)METHYL)6HYDROXY7METHYLCHROMEN2ONE
CC1=C(C=C2C(=CC(=O)OC2=C1)C(NH+)3CCN(CC3)C4=CC(=CC=C4)Cl)(O)
InChI=1SC21H21ClN2O3c11492018(1219(14)25)15(1021(26)2720)13235724(8623)1742316(22)1117h2491225H5813H21H3
ZINC54106049
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