Vitas-M small molecule compound

2-(1,3-benzothiazol-2-yl)-1-(2-chlorobenzyl)-4-methyl-5-[3-(morpholin-4-yl)propyl]-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione

Catalog ID
STK207245
SMILES Clc1ccccc1Cn1n(c2nc3c(s2)cccc3)c(=O)c2c1cc(=O)n(c2C)CCCN1CCOCC1

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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 C28H28ClN5O3S MW 550.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClN5O3S/c1-19-26-23(17-25(35)32(19)12-6-11-31-13-15-37-16-14-31)33(18-20-7-2-3-8-21(20)29)34(27(26)36)28-30-22-9-4-5-10-24(22)38-28/h2-5,7-10,17H,6,11-16,18H2,1H3
InChIKey
HAUIRJQRGRMAIV-UHFFFAOYSA-N
Synonyms

2(13BENZOTHIAZOL2YL)1((2CHLOROPHENYL)METHYL)4METHYL5(3MORPHOLIN4YLPROPYL)PYRAZOLO(43C)PYRIDINE36DIONE
2(13benzothiazol2yl)1(2chlorobenzyl)4methyl5(3(morpholin4yl)propyl)1Hpyrazolo(43c)pyridine36(2H5H)dione
2(BENZO(D)THIAZOL2YL)1(2CHLOROBENZYL)4METHYL5(3MORPHOLINOPROPYL)12DIHYDRO5HPYRAZOLO(43C)PYRIDINE36DIONE
2BENZOTHIAZOL2YL1((2CHLOROPHENYL)METHYL)4METHYL5(3MORPHOLIN4YLPROPYL)5HYDRO3PYRAZOLINO(43C)PYRIDINE36DIONE
CC1=C2C(=CC(=O)N1CCCN3CCOCC3)N(N(C2=O)C4=NC5=CC=CC=C5S4)CC6=CC=CC=C6Cl
InChI=1SC28H28ClN5O3Sc1192623(1725(35)32(19)1261131131537161431)33(1820723821(20)29)34(27(26)36)2830229451024(22)3828h2571017H6111618H21H3
MFCD06242255
ZINC000008769216
ZINC8769216

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Available files

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