Vitas-M small molecule compound

2-[({1-[2-(morpholin-4-ium-4-yl)ethyl]-1H-benzimidazol-2-yl}amino)methyl]phenolate

Catalog ID
STL047961
SMILES [O-]c1ccccc1CNc1nc2c(n1CC[NH+]1CCOCC1)cccc2

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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 C20H24N4O2 MW 352.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O2/c25-19-8-4-1-5-16(19)15-21-20-22-17-6-2-3-7-18(17)24(20)10-9-23-11-13-26-14-12-23/h1-8,25H,9-15H2,(H,21,22)
InChIKey
MWDQIYLWDRLJOQ-UHFFFAOYSA-N
Synonyms
577989-52-7
(O)c1ccccc1CNc1nc2c(n1CC(NH+)1CCOCC1)cccc2
2(((1(2(morpholin4ium4yl)ethyl)1Hbenzimidazol2yl)amino)methyl)phenolate
2(((1(2MORPHOLIN4IUM4YLETHYL)BENZIMIDAZOL2YL)AMINO)METHYL)PHENOLATE
2(((1(2MORPHOLIN4YLETHYL)BENZIMIDAZOL2YL)AMINO)METHYL)PHENOL
2((1(2MORPHOLIN4YLETHYL)1HBENZOIMIDAZOL2YLAMINO)METHYL)PHENOL
577989527
C1COCC(NH+)1CCN2C3=CC=CC=C3N=C2NCC4=CC=CC=C4(O)
InChI=1SC20H24N4O2c2519841516(19)1521202217623718(17)24(20)10923111326141223h1825H915H2(H2122)
MFCD04022318
ZINC000000809673
ZINC809673

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Available files

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