Vitas-M small molecule compound

N,N'-cyclohexane-1,4-diylbis[3-methyl-2-(4-methylphenyl)quinoline-4-carboxamide]

Catalog ID
STK439499
SMILES Cc1ccc(cc1)c1nc2ccccc2c(c1C)C(=O)NC1CCC(CC1)NC(=O)c1c(C)c(nc2c1cccc2)c1ccc(cc1)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 C42H40N4O2 MW 632.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H40N4O2/c1-25-13-17-29(18-14-25)39-27(3)37(33-9-5-7-11-35(33)45-39)41(47)43-31-21-23-32(24-22-31)44-42(48)38-28(4)40(30-19-15-26(2)16-20-30)46-36-12-8-6-10-34(36)38/h5-20,31-32H,21-24H2,1-4H3,(H,43,47)(H,44,48)
InChIKey
KREIOUDEVBRUJT-UHFFFAOYSA-N
Synonyms

(3METHYL2(4METHYLPHENYL)(4QUINOLYL))N(4((3METHYL2(4METHYLPHENYL)(4QUINOLYL))CARBONYLAMINO)CYCLOHEXYL)CARBOXAMIDE
3METHYLN(4((3METHYL2(4METHYLPHENYL)QUINOLINE4CARBONYL)AMINO)CYCLOHEXYL)2(4METHYLPHENYL)QUINOLINE4CARBOXAMIDE
CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2C)C(=O)NC4CCC(CC4)NC(=O)C5=C(C(=NC6=CC=CC=C65)C7=CC=C(C=C7)C)C
InChI=1SC42H40N4O2c125131729(181425)3927(3)37(339571135(33)4539)41(47)4331212332(242231)4442(48)3828(4)40(30191526(2)162030)463612861034(36)38h5203132H2124H214H3(H4347)(H4448)
MFCD03399057
NNcyclohexane14diylbis(3methyl2(4methylphenyl)quinoline4carboxamide)
ZINC000097949027
ZINC97949027

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Available files

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