Vitas-M small molecule compound

2-hydroxy-1,2-bis(4-methoxyphenyl)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium

Catalog ID
STL320837
SMILES COc1ccc(cc1)[N+]1=C2CCCCCN2CC1(O)c1ccc(cc1)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 C22H27N2O3 MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N2O3/c1-26-19-11-7-17(8-12-19)22(25)16-23-15-5-3-4-6-21(23)24(22)18-9-13-20(27-2)14-10-18/h7-14,25H,3-6,15-16H2,1-2H3/q+1
InChIKey
VFVJNRGPNASDHL-UHFFFAOYSA-N
Synonyms

12bis(4methoxyphenyl)356789hexahydroimidazo(12a)azepin4ium2ol
2hydroxy12bis(4methoxyphenyl)256789hexahydro3Himidazo(12a)azepin1ium
2hydroxy12bis(4methoxyphenyl)356789hexahydro2Himidazo(12a)azepin1iumbromide
COC1=CC=C(C=C1)C2(C(N+)3=C(N2C4=CC=C(C=C4)OC)CCCCC3)O
COc1ccc(cc1)(N+)1=C2CCCCCN2CC1(O)c1ccc(cc1)OC
COc1ccc(cc1)(N+)1=C2CCCCCN2CC1(O)c1ccc(cc1)OC(Br)
InChI=1SC22H27N2O3c1261911717(81219)22(25)162315534621(23)24(22)1891320(272)141018h71425H361516H212H3q+1
MFCD01037926
ZINC000013509849
ZINC000013509851

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Available files

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