Cas no 1190984-93-0 (6-benzyl-4-chloro-5,7-dihydropyrrolo[3,4-d]pyrimidine)

6-benzyl-4-chloro-5,7-dihydropyrrolo[3,4-d]pyrimidine structure
1190984-93-0 structure
Product Name:6-benzyl-4-chloro-5,7-dihydropyrrolo[3,4-d]pyrimidine
CAS No:1190984-93-0
MF:C13H12ClN3
MW:245.707481384277
MDL:MFCD14586405
CID:1037260
PubChem ID:50990945
Update Time:2025-04-20

6-benzyl-4-chloro-5,7-dihydropyrrolo[3,4-d]pyrimidine Chemical and Physical Properties

Names and Identifiers

    • 4-chloro-6,7-dihydro-6-(phenylmethyl)-5H-Pyrrolo[3,4-d]pyrimidine
    • 6-benzyl-4-chloro-5,7-dihydropyrrolo[3,4-d]pyrimidine
    • 6-Benzyl-4-chloro-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
    • DB-061521
    • KHHHSELDDQTJGM-UHFFFAOYSA-N
    • PB16023
    • DTXSID80679172
    • SCHEMBL2532723
    • 1190927-80-0
    • 6-Benzyl-4-chloro-5H,6H,7H-pyrrolo[3,4-d]pyrimidine
    • SB19949
    • 1190984-93-0
    • P10576
    • CS-0057268
    • MDL: MFCD14586405
    • Inchi: 1S/C13H12ClN3/c14-13-11-7-17(8-12(11)15-9-16-13)6-10-4-2-1-3-5-10/h1-5,9H,6-8H2
    • InChI Key: KHHHSELDDQTJGM-UHFFFAOYSA-N
    • SMILES: ClC1=C2C(CN(CC3C=CC=CC=3)C2)=NC=N1

Computed Properties

  • Exact Mass: 245.0719751g/mol
  • Monoisotopic Mass: 245.0719751g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 255
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 29?2

6-benzyl-4-chloro-5,7-dihydropyrrolo[3,4-d]pyrimidine Pricemore >>

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