Vitas-M small molecule compound
3-[4-(morpholin-4-yl)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STK772088
SMILES CC(Nc1nc(nc(n1)N1CCOCC1)N1CC2CC(C1)c1n(C2)c(=O)ccc1)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 C21H29N7O2 MW 411.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N7O2/c1-14(2)22-19-23-20(26-6-8-30-9-7-26)25-21(24-19)27-11-15-10-16(13-27)17-4-3-5-18(29)28(17)12-15/h3-5,14-16H,6-13H2,1-2H3,(H,22,23,24,25)InChIKey
QAPAITJEMFGVAZ-UHFFFAOYSA-NSynonyms
3(4(morpholin4yl)6(propan2ylamino)135triazin2yl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
CC(C)NC1=NC(=NC(=N1)N2CC3CC(C2)C4=CC=CC(=O)N4C3)N5CCOCC5
InChI=1SC21H29N7O2c114(2)22192320(2668309726)2521(2419)2711151016(1327)1743518(29)28(17)1215h351416H613H212H3(H22232425)
MFCD03768111
ZINC000004581205
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