Vitas-M small molecule compound
[1-(carboxymethyl)-5-methoxy-1H-indol-3-yl][4-(pyrimidin-2-yl)-1,4-diazepan-1-yl]acetic acid
Catalog ID
STK659559
SMILES COc1ccc2c(c1)c(cn2CC(=O)O)C(N1CCCN(CC1)c1ncccn1)C(=O)O
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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 C22H25N5O5 MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O5/c1-32-15-4-5-18-16(12-15)17(13-27(18)14-19(28)29)20(21(30)31)25-8-3-9-26(11-10-25)22-23-6-2-7-24-22/h2,4-7,12-13,20H,3,8-11,14H2,1H3,(H,28,29)(H,30,31)InChIKey
HXTTVUKECAUSFZ-UHFFFAOYSA-NSynonyms
1214703-01-1(1(carboxymethyl)5methoxy1Hindol3yl)(4(pyrimidin2yl)14diazepan1yl)aceticacid
1214703011
2(1(carboxymethyl)5methoxy1Hindol3yl)2(4(pyrimidin2yl)14diazepan1yl)aceticacid
2(1(carboxymethyl)5methoxyindol3yl)2(4pyrimidin2yl14diazepan1yl)aceticacid
COC1=CC2=C(C=C1)N(C=C2C(C(=O)O)N3CCCN(CC3)C4=NC=CC=N4)CC(=O)O
InChI=1SC22H25N5O5c13215451816(1215)17(1327(18)1419(28)29)20(21(30)31)2583926(111025)22236272422h247121320H381114H21H3(H2829)(H3031)
MFCD13760700
ZINC000036366120
ZINC000036366122
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