Cas no 859826-41-8 (5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-4-one)

5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-4-one structure
859826-41-8 structure
Product Name:5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-4-one
CAS No:859826-41-8
MF:C7H9N3O
MW:151.165860891342
MDL:MFCD32632444
CID:706529
PubChem ID:135741601
Update Time:2025-04-19

5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-4-one Chemical and Physical Properties

Names and Identifiers

    • 5,6,7,8-Tetrahydropyrido[3,4-d]pyrimidin-4(3H)-one
    • 5,6,7,8-tetrahydro-Pyrido[3,4-d]pyrimidin-4(3H)-one
    • 5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(4aH)-one
    • 5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(4aH)-one hydrochloride
    • Pyrido[3,4-d]pyrimidin-4(3H)-one,5,6,7,8-tetrahydro-
    • 5,6,7,8-Tetrahydropyrido<2,3-d>pyrimidine
    • 5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-4-one
    • CS-D0072
    • A847071
    • 859826-41-8
    • AKOS006347218
    • SCHEMBL17298716
    • DVHCRTQZUZFLAY-UHFFFAOYSA-N
    • 5,6,7,8-TETRAHYDRO-3H-PYRIDO[3,4-D]PYRIMIDIN-4-ONE
    • EN300-132141
    • AKOS025149075
    • SCHEMBL4872148
    • 3H,4H,5H,6H,7H,8H-PYRIDO[3,4-D]PYRIMIDIN-4-ONE
    • F21479
    • 5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4 (3H)-one
    • AB49113
    • DB-076508
    • 3H,5H,6H,7H,8H-PYRIDO[3,4-D]PYRIMIDIN-4-ONE
    • 5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-ol
    • MDL: MFCD32632444
    • Inchi: 1S/C7H9N3O/c11-7-5-1-2-8-3-6(5)9-4-10-7/h4,8H,1-3H2,(H,9,10,11)
    • InChI Key: DVHCRTQZUZFLAY-UHFFFAOYSA-N
    • SMILES: O=C1C2=C(CNCC2)N=CN1

Computed Properties

  • Exact Mass: 151.07500
  • Monoisotopic Mass: 151.074561919g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 254
  • 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: -1.3
  • Topological Polar Surface Area: 53.5?2

Experimental Properties

  • Density: 1.51±0.1 g/cm3 (20 oC 760 Torr)
  • PSA: 58.04000
  • LogP: 0.15670

5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-4-one Pricemore >>

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