Vitas-M small molecule compound

N-{4-[(4-benzylpiperazin-1-yl)carbonyl]-1-(2-chlorophenyl)-1H-pyrazol-5-yl}-2-chlorobenzamide

Catalog ID
STK002376
SMILES Clc1ccccc1n1ncc(c1NC(=O)c1ccccc1Cl)C(=O)N1CCN(CC1)Cc1ccccc1

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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 C28H25Cl2N5O2 MW 534.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25Cl2N5O2/c29-23-11-5-4-10-21(23)27(36)32-26-22(18-31-35(26)25-13-7-6-12-24(25)30)28(37)34-16-14-33(15-17-34)19-20-8-2-1-3-9-20/h1-13,18H,14-17,19H2,(H,32,36)
InChIKey
XXTDRNRRGZCVOT-UHFFFAOYSA-N
Synonyms

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4Cl)NC(=O)C5=CC=CC=C5Cl
Clc1ccccc1n1ncc(c1NC(=O)c1ccccc1Cl)C(=O)N1CCN(CC1)Cc1ccccc1
InChI=1SC28H25Cl2N5O2c292311541021(23)27(36)322622(183135(26)2513761224(25)30)28(37)34161433(151734)19208213920h11318H141719H2(H3236)
MFCD03369771
N(4((4BENZYLPIPERAZIN1YL)CARBONYL)1(2CHLOROPHENYL)1HPYRAZOL5YL)2CHLOROBENZAMIDE
N(4(4BENZYLPIPERAZINE1CARBONYL)2(2CHLOROPHENYL)PYRAZOL3YL)2CHLOROBENZAMIDE
STK002376
ZINC000098005156
ZINC98005156

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Available files

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