Cas no 70586-71-9 (Copper(2+),bis[(3S,6S)-3,6-bis[(1H-imidazol-4-yl-kN3)methyl]-2,5-piperazinedione]-, (T-4)- (9CI))

Copper(2+),bis[(3S,6S)-3,6-bis[(1H-imidazol-4-yl-kN3)methyl]-2,5-piperazinedione]-, (T-4)- (9CI) structure
70586-71-9 structure
Product Name:Copper(2+),bis[(3S,6S)-3,6-bis[(1H-imidazol-4-yl-kN3)methyl]-2,5-piperazinedione]-, (T-4)- (9CI)
CAS No:70586-71-9
MF:C24H28CuN12O4
MW:612.103123664856
CID:570502
PubChem ID:189760
Update Time:2025-04-19

Copper(2+),bis[(3S,6S)-3,6-bis[(1H-imidazol-4-yl-kN3)methyl]-2,5-piperazinedione]-, (T-4)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Copper(2+),bis[(3S,6S)-3,6-bis[(1H-imidazol-4-yl-kN3)methyl]-2,5-piperazinedione]-, (T-4)- (9CI)
    • bis(cyclo(histidylhistidine))copper(II) complex
    • copper,3,6-bis(1H-imidazol-5-ylmethyl)piperazine-2,5-dione
    • copper;3,6-bis(1H-imidazol-5-ylmethyl)piperazine-2,5-dione
    • Copper(2+), bis(3,6-bis(1H-imidazol-5-ylmethyl)-2,5-piperazinedione)-, (T-4-(3S-cis),(3S-cis))-
    • Bchhcu
    • 70586-71-9
    • Inchi： 1S/2C12H14N6O2.Cu/c2*19-11-9(1-7-3-13-5-15-7)17-12(20)10(18-11)2-8-4-14-6-16-8;/h2*3-6,9-10H,1-2H2,(H,13,15)(H,14,16)(H,17,20)(H,18,19);/q;;+2
    • InChI Key： DTLBUZPOJVRBHU-UHFFFAOYSA-N
    • SMILES： [Cu+2].O=C1C(CC2=CN=CN2)NC(C(CC2=CN=CN2)N1)=O.O=C1C(CC2=CN=CN2)NC(C(CC2=CN=CN2)N1)=O

Computed Properties

  • Exact Mass: 611.165
  • Monoisotopic Mass: 611.165
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 8
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 41
  • Rotatable Bond Count: 8
  • Complexity: 354
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 2
  • Tautomer Count: 231
  • XLogP3: nothing
  • Topological Polar Surface Area: 231?2

Experimental Properties

  • Boiling Point: 915.3°C at 760 mmHg
  • Flash Point: 507.4°C

Copper(2+),bis[(3S,6S)-3,6-bis[(1H-imidazol-4-yl-kN3)methyl]-2,5-piperazinedione]-, (T-4)- (9CI) Related Literature

70586-71-9 (Copper(2+),bis[(3S,6S)-3,6-bis[(1H-imidazol-4-yl-kN3)methyl]-2,5-piperazinedione]-, (T-4)- (9CI)) Related Products

Recommended suppliers
Suzhou Genelee Bio-Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Suzhou Genelee Bio-Technology Co., Ltd.
Wuhan Comings Biotechnology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Wuhan Comings Biotechnology Co., Ltd.
Jiangsu Kolod Food Ingredients Co.,ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Kolod Food Ingredients Co.,ltd
Nantong Boya Environmental Protection Technology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nantong Boya Environmental Protection Technology Co., Ltd
煙臺朗裕新材料科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent