Vitas-M small molecule compound

methyl 3-{[(4'-carbamoyl-1,4'-bipiperidin-1'-yl)acetyl]amino}-1H-indole-2-carboxylate

Catalog ID
STL347183
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)(C(=O)N)N1CCCCC1)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 C23H31N5O4 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N5O4/c1-32-21(30)20-19(16-7-3-4-8-17(16)25-20)26-18(29)15-27-13-9-23(10-14-27,22(24)31)28-11-5-2-6-12-28/h3-4,7-8,25H,2,5-6,9-15H2,1H3,(H2,24,31)(H,26,29)
InChIKey
SZCGSBOXQXIPNN-UHFFFAOYSA-N
Synonyms
849020-80-0
849020800
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCC(CC1)(C(=O)N)N1CCCCC1)cccc2
COC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CN3CCC(CC3)(C(=O)N)N4CCCCC4
InChI=1SC23H31N5O4c13221(30)2019(16734817(16)2520)2618(29)152713923(10142722(24)31)28115261228h347825H256915H21H3(H22431)(H2629)
methyl3(((4carbamoyl14bipiperidin1yl)acetyl)amino)1Hindole2carboxylate
METHYL3((2(4CARBAMOYL4PIPERIDIN1YLPIPERIDIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl3(2(4carbamoyl(14bipiperidin)1yl)acetamido)1Hindole2carboxylate
MFCD05681209
ZINC000002453091
ZINC2453091

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Available files

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