Vitas-M small molecule compound

N-cyclohexyl-4-{4-methyl-3-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}phthalazin-1-amine

Catalog ID
STK015881
SMILES CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)NC1CCCCC1

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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 C26H33N5O2S MW 479.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N5O2S/c1-19-12-13-20(18-24(19)34(32,33)31-16-14-30(2)15-17-31)25-22-10-6-7-11-23(22)26(29-28-25)27-21-8-4-3-5-9-21/h6-7,10-13,18,21H,3-5,8-9,14-17H2,1-2H3,(H,27,29)
InChIKey
NKZYFXVHBPRNDO-UHFFFAOYSA-N
Synonyms
442648-02-4
442648024
CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4CCCCC4)S(=O)(=O)N5CCN(CC5)C
CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)NC1CCCCC1
CYCLOHEXYL(4(4METHYL3(4METHYLPIPERAZINE1SULFONYL)PHENYL)PHTHALAZIN1YL)AMINE
InChI=1SC26H33N5O2Sc119121320(1824(19)34(3233)31161430(2)151731)252210671123(22)26(292825)27218435921h6710131821H35891417H212H3(H2729)
MFCD03290460
NCYCLOHEXYL4(4METHYL3((4METHYLPIPERAZIN1YL)SULFONYL)PHENYL)PHTHALAZIN1AMINE
NCYCLOHEXYL4(4METHYL3(4METHYLPIPERAZIN1YL)SULFONYLPHENYL)PHTHALAZIN1AMINE
STK015881
ZINC000008829116
ZINC8829116

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Available files

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