Vitas-M small molecule compound
2,5-bis{[bis(2-chloroethyl)amino]methyl}-1,6-bis(4-propoxyphenyl)hexane-1,6-diol
Catalog ID
STK524644
SMILES ClCCN(CC(C(c1ccc(cc1)OCCC)O)CCC(C(c1ccc(cc1)OCCC)O)CN(CCCl)CCCl)CCCl
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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 C34H52Cl4N2O4 MW 694.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H52Cl4N2O4/c1-3-23-43-31-11-7-27(8-12-31)33(41)29(25-39(19-15-35)20-16-36)5-6-30(26-40(21-17-37)22-18-38)34(42)28-9-13-32(14-10-28)44-24-4-2/h7-14,29-30,33-34,41-42H,3-6,15-26H2,1-2H3InChIKey
VOTQFRADSFRZND-UHFFFAOYSA-NSynonyms
25bis((bis(2chloroethyl)amino)methyl)16bis(4propoxyphenyl)hexane16diol
25BIS(BIS(2CHLOROETHYL)AMINOMETHYL)16BIS(4PROPOXYPHENYL)HEXANE16DIOL
CCCOC1=CC=C(C=C1)C(C(CCC(CN(CCCl)CCCl)C(C2=CC=C(C=C2)OCCC)O)CN(CCCl)CCCl)O
InChI=1SC34H52Cl4N2O4c1323433111727(81231)33(41)29(2539(191535)201636)5630(2640(211737)221838)34(42)2891332(141028)442442h714293033344142H361526H212H3
MFCD00699633
ZINC000150405653
ZINC000245328604
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