Vitas-M small molecule compound

3-[(6,7-dimethoxy-2-methyl-4-oxoquinazolin-3(4H)-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STL476204
SMILES COc1cc2nc(C)n(c(=O)c2cc1OC)CC(=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 C24H26N4O5 MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O5/c1-14-25-18-9-21(33-3)20(32-2)8-17(18)24(31)27(14)13-23(30)26-10-15-7-16(12-26)19-5-4-6-22(29)28(19)11-15/h4-6,8-9,15-16H,7,10-13H2,1-3H3
InChIKey
OKJHSCJQQHCLBN-UHFFFAOYSA-N
Synonyms

(1R5S)3(2(67dimethoxy2methyl4oxoquinazolin3(4H)yl)acetyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3((67dimethoxy2methyl4oxoquinazolin3(4H)yl)acetyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
CC1=NC2=CC(=C(C=C2C(=O)N1CC(=O)N3CC4CC(C3)C5=CC=CC(=O)N5C4)OC)OC
COc1cc2nc(C)n(c(=O)c2cc1OC)CC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC24H26N4O5c1142518921(333)20(322)817(18)24(31)27(14)1323(30)261015716(1226)1954622(29)28(19)1115h46891516H71013H213H3
MFCD31751343
ZINC000225421769

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Available files

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