Vitas-M small molecule compound
(5-chloro-1H-indol-3-yl)[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]acetic acid
Catalog ID
STL239895
SMILES OC(=O)C(c1c[nH]c2c1cc(Cl)cc2)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2
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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 C23H22ClN3O5 MW 455.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O5/c24-14-5-6-17-15(11-14)16(12-25-17)21(23(29)30)26-7-9-27(10-8-26)22(28)20-13-31-18-3-1-2-4-19(18)32-20/h1-6,11-12,20-21,25H,7-10,13H2,(H,29,30)InChIKey
ADNACQYCWFLJAP-UHFFFAOYSA-NSynonyms
1081135-26-3(5chloro1Hindol3yl)(4(23dihydro14benzodioxin2ylcarbonyl)piperazin1yl)aceticacid
1081135263
2(5chloro1Hindol3yl)2(4(23dihydro14benzodioxine3carbonyl)piperazin1yl)aceticacid
2(5chloro1Hindol3yl)2(4(23dihydrobenzo(b)(14)dioxine2carbonyl)piperazin1yl)aceticacid
C1CN(CCN1C(C2=CNC3=C2C=C(C=C3)Cl)C(=O)O)C(=O)C4COC5=CC=CC=C5O4
InChI=1SC23H22ClN3O5c2414561715(1114)16(122517)21(23(29)30)267927(10826)22(28)20133118312419(18)3220h161112202125H71013H2(H2930)
MFCD12207260
OC(=O)C(c1c(nH)c2c1cc(Cl)cc2)N1CCN(CC1)C(=O)C1COc2c(O1)cccc2
ZINC000020726514
ZINC000020726524
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