1.0 2018-10-03 16:33:14 UTC 2020-06-04 18:57:31 UTC BMDB0063610 BMDB63610 o,p′-DDD Mitotane is a derivative of the insecticide dichlorodiphenyldichloroethane that specifically inhibits cells of the adrenal cortex and their production of hormones. It is used to treat adrenocortical tumors and causes CNS damage, but no bone marrow depression (PubChem). Its biochemical mechanism of action is unknown, although data are available to suggest that it modifies the peripheral metabolism of steroids as well as directly suppressing the adrenal cortex. Lysodren Bristol myers squibb brand OF mitotane Khloditan ortho,Para-DDD Chloditan Bristol-myers squibb brand OF mitotane O,P-DDD ortho,Para DDD Chlodithane Mytotan C14H10Cl4 320.041 317.953661148 1-chloro-4-[2,2-dichloro-1-(2-chlorophenyl)ethyl]benzene mitotane 53-19-0 ClC(Cl)C(C1=CC=C(Cl)C=C1)C1=CC=CC=C1Cl InChI=1S/C14H10Cl4/c15-10-7-5-9(6-8-10)13(14(17)18)11-3-1-2-4-12(11)16/h1-8,13-14H JWBOIMRXGHLCPP-UHFFFAOYSA-N belongs to the class of organic compounds known as diphenylmethanes. Diphenylmethanes are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups. Organic compounds Benzenoids Benzene and substituted derivatives Diphenylmethanes Diphenylmethanes Alkyl chlorides Aryl chlorides Chlorobenzenes Hydrocarbon derivatives Organochlorides Alkyl chloride Alkyl halide Aromatic homomonocyclic compound Aryl chloride Aryl halide Chlorobenzene Diphenylmethane Halobenzene Hydrocarbon derivative Organochloride Organohalogen compound Aromatic homomonocyclic compounds logp 6.08 ALOGPS logs -7.53 ALOGPS logp 6.11 ChemAxon iupac 1-chloro-4-[2,2-dichloro-1-(2-chlorophenyl)ethyl]benzene ChemAxon average_mass 320.041 ChemAxon mono_mass 317.953661148 ChemAxon smiles ClC(Cl)C(C1=CC=C(Cl)C=C1)C1=CC=CC=C1Cl ChemAxon formula C14H10Cl4 ChemAxon inchi InChI=1S/C14H10Cl4/c15-10-7-5-9(6-8-10)13(14(17)18)11-3-1-2-4-12(11)16/h1-8,13-14H ChemAxon inchikey JWBOIMRXGHLCPP-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 79.97 ChemAxon polarizability 29.93 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 2 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::EiMs 309 Specdb::CMs 14469 Specdb::CMs 31695 Specdb::CMs 100163 Specdb::CMs 117961 Specdb::CMs 160567 Specdb::NmrOneD 2441 Specdb::NmrOneD 3129 Specdb::MsMs 54816 Specdb::MsMs 54817 Specdb::MsMs 54818 Specdb::MsMs 154383 Specdb::MsMs 154384 Specdb::MsMs 154385 Specdb::MsMs 3218377 Specdb::MsMs 3218378 Specdb::MsMs 3218379 Specdb::MsMs 3218380 Specdb::MsMs 3218381 Specdb::MsMs 3218382 Milk 0.00250 +/- 0.00750 uM Raw bovine milk from Haryana (n=147) Sharma HR, Kaushik A, Kaushik CP: Pesticide residues in bovine milk from a predominantly agricultural state of Haryana, India. Environ Monit Assess. 2007 Jun;129(1-3):349-57. doi: 10.1007/s10661-006-9368-5. Epub 2006 Dec 16. 17180431 4066 DB00648 Mitotane Sharma HR, Kaushik A, Kaushik CP: Pesticide residues in bovine milk from a predominantly agricultural state of Haryana, India. Environ Monit Assess. 2007 Jun;129(1-3):349-57. doi: 10.1007/s10661-006-9368-5. Epub 2006 Dec 16. 17180431