Vitas-M small molecule compound

3-[(3,4,5-trimethoxyphenyl)carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STL442815
SMILES COc1c(OC)cc(cc1OC)C(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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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 C21H24N2O5 MW 384.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5/c1-26-17-8-14(9-18(27-2)20(17)28-3)21(25)22-10-13-7-15(12-22)16-5-4-6-19(24)23(16)11-13/h4-6,8-9,13,15H,7,10-12H2,1-3H3
InChIKey
ZAWJPZQSFHYQBJ-UHFFFAOYSA-N
Synonyms

(1R5S)3(345trimethoxybenzoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3((345trimethoxyphenyl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
COC1=CC(=CC(=C1OC)OC)C(=O)N2CC3CC(C2)C4=CC=CC(=O)N4C3
COc1c(OC)cc(cc1OC)C(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC21H24N2O5c12617814(918(272)20(17)283)21(25)221013715(1222)1654619(24)23(16)1113h46891315H71012H213H3
MFCD08273279
ZINC000006623968

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Available files

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