Vitas-M small molecule compound

2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[4-(dimethylamino)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK990171
SMILES COc1ccc(cc1OC)CCNC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(cc1)N(C)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 C29H30N6O3 MW 510.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N6O3/c1-34(2)19-10-12-20(13-11-19)35-27(30)25(26-28(35)33-22-8-6-5-7-21(22)32-26)29(36)31-16-15-18-9-14-23(37-3)24(17-18)38-4/h5-14,17H,15-16,30H2,1-4H3,(H,31,36)
InChIKey
XXKOUIHOILQRKA-UHFFFAOYSA-N
Synonyms
376622-21-8
2aminoN(2(34dimethoxyphenyl)ethyl)1(4(dimethylamino)phenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(2(34dimethoxyphenyl)ethyl)1(4(dimethylamino)phenyl)pyrrolo(32b)quinoxaline3carboxamide
2AMINON(2(34DIMETHOXYPHENYL)ETHYL)1(4DIMETHYLAMINOPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2aminoN(34dimethoxyphenethyl)1(4(dimethylamino)phenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
376622218
CN(C)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC(=C(C=C5)OC)OC)N
InChI=1SC29H30N6O3c134(2)19101220(131119)3527(30)25(2628(35)3322865721(22)3226)29(36)3116151891423(373)24(1718)384h51417H151630H214H3(H3136)
MFCD02164635
ZINC000008871067
ZINC08871067
ZINC8871067

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Available files

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