SN2

5-[BIS-2(CHLORO-ETHYL)-AMINO]-2,4-DINTRO-BENZAMIDE

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Chemical Component Summary
Name	5-[BIS-2(CHLORO-ETHYL)-AMINO]-2,4-DINTRO-BENZAMIDE
Identifiers	5-[bis(2-chloroethyl)amino]-2,4-dinitro-benzamide
Formula	C₁₁ H₁₂ Cl₂ N₄ O₅
Molecular Weight	351.143
Type	NON-POLYMER
Isomeric SMILES	c1c(c(cc(c1N(CCCl)CCCl)[N+](=O)[O-])[N+](=O)[O-])C(=O)N
InChI	InChI=1S/C11H12Cl2N4O5/c12-1-3-15(4-2-13)9-5-7(11(14)18)8(16(19)20)6-10(9)17(21)22/h5-6H,1-4H2,(H2,14,18)
InChIKey	DQMALWRRERBILB-UHFFFAOYSA-N

Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	34
Aromatic Bond Count	6

Drug Info: DrugBank

DrugBank ID	DB03228
Name	5-[Bis-2(Chloro-Ethyl)-Amino]-2,4-Dintro-Benzamide
Groups	experimental
Synonyms	5-[Bis-2(Chloro-Ethyl)-Amino]-2,4-Dintro-Benzamide

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Oxygen-insensitive NAD(P)H nitroreductase	MDIISVALKRHSTKAFDASKKLTPEQAEQIKTLLQYSPSSTNSQPWHFIV...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682