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Volumn 142, Issue 6, 2011, Pages 609-618

Experimental and theoretical investigation of substituent effects in a two-pathway reaction of tetrahydro-1,5-benzodiazepine-2-thiones with 4-substituted 2-bromoacetophenones

Author keywords

5 Acyl 1,3,4,5 tetrahydro 2H 1,5 benzodiazepine 2 thiones; Cyclizations; Density functional theory; Semiempirical calculations; Structure activity relationships

Indexed keywords


EID: 79958092058     PISSN: 00269247     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00706-011-0496-4     Document Type: Article
Times cited : (9)

References (22)
  • 1
    • 0035672096 scopus 로고    scopus 로고
    • 1,5-Benzodiazepines. Part XII. Synthesis and biological evaluation of tricyclic and tetracyclic 1,5-benzodiazepine derivatives as nevirapine analogues
    • DOI 10.1016/S0223-5234(01)01283-1, PII S0223523401012831
    • M Di Braccio G Grossi G Roma L Vargiu M Mura ME Marongiu 2001 Eur J Med Chem 36 935 10.1016/S0223-5234(01)01283-1 1:CAS:528:DC%2BD38XitVar (Pubitemid 34033704)
    • (2001) European Journal of Medicinal Chemistry , vol.36 , Issue.11-12 , pp. 935-949
    • Di Braccio, M.1    Grossi, G.2    Roma, G.3    Vargiu, L.4    Mura, M.5    Marongiu, M.E.6
  • 6
    • 79958174014 scopus 로고
    • For reviews see US Patent 3321468
    • For reviews see: Krapcho J, Turk CF (1967) US Patent 3321468; (1968) Chem Abstr 68:21970
    • (1967) Chem Abstr , vol.68 , pp. 21970
    • Krapcho, J.1    Turk, C.F.2
  • 9
    • 0006183252 scopus 로고    scopus 로고
    • 10.1016/S0166-1280(97)00209-1 1:CAS:528:DyaK1cXhvF2nsr8%3D
    • BS Jursic 1998 J Mol Struct (Theochem) 427 165 10.1016/S0166-1280(97) 00209-1 1:CAS:528:DyaK1cXhvF2nsr8%3D
    • (1998) J Mol Struct (Theochem) , vol.427 , pp. 165
    • Jursic, B.S.1
  • 10
    • 0010858732 scopus 로고    scopus 로고
    • 10.1139/v96-015 1:CAS:528:DyaK28XhsVKjurc%3D
    • BS Jursic 1996 Can J Chem 74 114 10.1139/v96-015 1:CAS:528: DyaK28XhsVKjurc%3D
    • (1996) Can J Chem , vol.74 , pp. 114
    • Jursic, B.S.1
  • 12
    • 84987055346 scopus 로고
    • 10.1002/qua.560540304 1:CAS:528:DyaK2MXksFCrtbs%3D
    • BS Jursic Z Zdravskovski 1995 Int J Quantum Chem 54 161 10.1002/qua.560540304 1:CAS:528:DyaK2MXksFCrtbs%3D
    • (1995) Int J Quantum Chem , vol.54 , pp. 161
    • Jursic, B.S.1    Zdravskovski, Z.2
  • 15
    • 77954574454 scopus 로고    scopus 로고
    • 10.1007/s00894-009-0634-7 1:CAS:528:DC%2BC3cXlslGhs70%3D
    • G Fayet P Rotureau L Joubert C Adamo 2010 J Mol Model 16 805 10.1007/s00894-009-0634-7 1:CAS:528:DC%2BC3cXlslGhs70%3D
    • (2010) J Mol Model , vol.16 , pp. 805
    • Fayet, G.1    Rotureau, P.2    Joubert, L.3    Adamo, C.4
  • 16
    • 4043072686 scopus 로고    scopus 로고
    • Quantum descriptors for biological macromolecules from linear-scaling electronic structure methods
    • DOI 10.1002/prot.20171
    • J Khandogin DM York 2004 Proteins: Struct, Funct, Bioinf 56 724 10.1002/prot.20171 1:CAS:528:DC%2BD2cXmvVOjtb8%3D (Pubitemid 39063316)
    • (2004) Proteins: Structure, Function and Genetics , vol.56 , Issue.4 , pp. 724-737
    • Khandogin, J.1    York, D.M.2
  • 17
    • 84988098098 scopus 로고
    • 10.1002/jcc.540080616 1:CAS:528:DyaL2sXmt1emsro%3D
    • LE Chirlian MM Francl 1987 J Comput Chem 8 894 10.1002/jcc.540080616 1:CAS:528:DyaL2sXmt1emsro%3D
    • (1987) J Comput Chem , vol.8 , pp. 894
    • Chirlian, L.E.1    Francl, M.M.2
  • 21
    • 0042534101 scopus 로고
    • 10.1021/ja00326a036 1:CAS:528:DyaL2cXkt1ynsrc%3D
    • RG Parr W Yang 1984 J Am Chem Soc 106 4049 10.1021/ja00326a036 1:CAS:528:DyaL2cXkt1ynsrc%3D
    • (1984) J Am Chem Soc , vol.106 , pp. 4049
    • Parr, R.G.1    Yang, W.2
  • 22
    • 0034620741 scopus 로고    scopus 로고
    • Variational principles for describing chemical reactions: The Fukui function and chemical hardness revisited
    • DOI 10.1021/ja9924039
    • PW Ayres RG Parr 2000 J Am Chem Soc 122 2010 10.1021/ja9924039 (Pubitemid 30143904)
    • (2000) Journal of the American Chemical Society , vol.122 , Issue.9 , pp. 2010-2018
    • Ayers, P.W.1    Parr, R.G.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.