Vitas-M small molecule compound

1-(3,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene

Catalog ID
STL520640
SMILES COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2)c1ccc(c(c1)OC)OC

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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 C25H26N2O3 MW 402.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O3/c1-28-19-10-7-17(8-11-19)22-16-26-15-21(20-6-4-5-13-27(22)25(20)26)18-9-12-23(29-2)24(14-18)30-3/h7-12,14-16H,4-6,13H2,1-3H3
InChIKey
BMGUQXNMYRHJBI-UHFFFAOYSA-N
Synonyms
672893-88-8
1(34dimethoxyphenyl)4(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene
1427308
6(34dimethoxyphenyl)2(4methoxyphenyl)14diazatricyclo(5410^(412))dodeca257(12)triene
672893888
InChI=1SC25H26N2O3c1281910717(81119)2216261521(206451327(22)25(20)26)1891223(292)24(1418)303h7121416H4613H213H3
MFCD03266726
ZINC000001322647
ZINC1322647

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Available files

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