Tallimustine

CAS

115308-98-0

Catalog Number

ACM115308980

Category

Other Products

Molecular Weight

697.615 g/mol

Molecular Formula

C₃₂₀H₃₈Cl₂N₁₀O₄

MSDS COA Spec Sheet

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Specification

Synonyms

1H-Pyrrole-2-carboxamide,N-(5-(((3-amino-3-iminopropyl)amino)carbonyl)-1-methyl-1H-pyrrol-3-yl)-4-(((4-((4-(bis(2-chloroethyl)amino)benzoyl)amino)-1-methyl-1H-pyrrol-2-yl)carbonyl)amino)-1-methyl; Tallimustine; Tallimustine [INN];

IUPAC Name

N-[5-[[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-4-[[4-[bis(2-chloroethyl)amino]benzoyl]amino]-1-methylpyrrole-2-carboxamide

Canonical SMILES

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=N)N)C)C)NC(=O)C4=CC=C(C=C4)N(CCCl)CCCl

InChI Key

ARKYUICTMUZVEW-UHFFFAOYSA-N

Density

1.41g/cm³

Exact Mass

696.24500

H-Bond Acceptor

H-Bond Donor