Vitas-M small molecule compound

2-[(2-hydroxyethyl)amino]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK699946
SMILES OCCNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3

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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 C26H29N3O3 MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O3/c1-32-20-11-9-19(10-12-20)29-24(31)22-23(28-25(29)27-15-16-30)21-8-4-3-7-18(21)17-26(22)13-5-2-6-14-26/h3-4,7-12,30H,2,5-6,13-17H2,1H3,(H,27,28)
InChIKey
DCWJBTAADAETJG-UHFFFAOYSA-N
Synonyms
308290-15-5
2((2hydroxyethyl)amino)3(4methoxyphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(2HYDROXYETHYLAMINO)3(4METHOXYPHENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
308290155
COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2NCCO
InChI=1SC26H29N3O3c1322011919(101220)2924(31)2223(2825(29)27151630)21843718(21)1726(22)135261426h3471230H2561317H21H3(H2728)
MFCD01175091
ZINC000002272680
ZINC02272680
ZINC2272680

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Available files

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