Vitas-M small molecule compound

Catalog ID
STK572990
SMILES CCC([C@@H](C(=O)O)NC(=O)Nc1ccc(c(c1)Cl)Cl)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 C13H16Cl2N2O3 MW 319.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16Cl2N2O3/c1-3-7(2)11(12(18)19)17-13(20)16-8-4-5-9(14)10(15)6-8/h4-7,11H,3H2,1-2H3,(H,18,19)(H2,16,17,20)/t7?,11-/m0/s1
InChIKey
OXSAJRXZZRQLAN-QRIDDKLISA-N
Synonyms
1173681-77-0
(2S)2((34dichlorophenyl)carbamoylamino)3methylpentanoicacid
(2S3R)2(3(34dichlorophenyl)ureido)3methylpentanoicacid
1173681770
CCC((C@@H)(C(=O)O)NC(=O)Nc1ccc(c(c1)Cl)Cl)C
CCC(C)C(C(=O)O)NC(=O)NC1=CC(=C(C=C1)Cl)Cl
InChI=1SC13H16Cl2N2O3c137(2)11(12(18)19)1713(20)168459(14)10(15)68h4711H3H212H3(H1819)(H2161720)t7?11m0s1
MFCD04165582
ZINC000005354730
ZINC000013576650

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Available files

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