Vitas-M small molecule compound

6,7-dimethoxy-N-{(2S)-1-oxo-1-[(pyridin-2-ylmethyl)amino]propan-2-yl}-1-phenyl-3,4-dihydroisoquinoline-2(1H)-carboxamide

Catalog ID
STK619306
SMILES COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)N[C@H](C(=O)NCc1ccccn1)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 C27H30N4O4 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O4/c1-18(26(32)29-17-21-11-7-8-13-28-21)30-27(33)31-14-12-20-15-23(34-2)24(35-3)16-22(20)25(31)19-9-5-4-6-10-19/h4-11,13,15-16,18,25H,12,14,17H2,1-3H3,(H,29,32)(H,30,33)/t18-,25?/m0/s1
InChIKey
YVKPVUPRWSRFTH-CPFIQGLUSA-N
Synonyms

67dimethoxyN((2S)1oxo1((pyridin2ylmethyl)amino)propan2yl)1phenyl34dihydroisoquinoline2(1H)carboxamide
67dimethoxyN((2S)1oxo1(pyridin2ylmethylamino)propan2yl)1phenyl34dihydro1Hisoquinoline2carboxamide
67dimethoxyN((S)1oxo1((pyridin2ylmethyl)amino)propan2yl)1phenyl34dihydroisoquinoline2(1H)carboxamide
67DIMETHOXYN(1METHYL2OXO2((2PYRIDINYLMETHYL)AMINO)ETHYL)1PHENYL34DIHYDRO2(1H)ISOQUINOLINECARBOXAMIDE
CC(C(=O)NCC1=CC=CC=N1)NC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC
COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)N(C@H)(C(=O)NCc1ccccn1)C
InChI=1SC27H30N4O4c118(26(32)2917211178132821)3027(33)311412201523(342)24(353)1622(20)25(31)1995461019h4111315161825H121417H213H3(H2932)(H3033)t1825?m0s1
MFCD10488779
ZINC000009341110
ZINC000009341112

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.