Cas no 2138016-52-9 (1-{5-[(4-Amino-3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl}-3-(2-methoxyethyl)urea)

1-{5-[(4-Amino-3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl}-3-(2-methoxyethyl)urea structure
2138016-52-9 structure
Product Name:1-{5-[(4-Amino-3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl}-3-(2-methoxyethyl)urea
CAS No:2138016-52-9
MF:C14H25N5O2S
MW:327.445601224899
CID:5608725
PubChem ID:165486301
Update Time:2023-09-03

1-{5-[(4-Amino-3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl}-3-(2-methoxyethyl)urea Chemical and Physical Properties

Names and Identifiers

    • EN300-842656
    • 2138016-52-9
    • 1-{5-[(4-amino-3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl}-3-(2-methoxyethyl)urea
    • 1-{5-[(4-Amino-3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl}-3-(2-methoxyethyl)urea
    • Inchi: 1S/C14H25N5O2S/c1-10-8-19(5-3-12(10)15)9-11-7-17-14(22-11)18-13(20)16-4-6-21-2/h7,10,12H,3-6,8-9,15H2,1-2H3,(H2,16,17,18,20)
    • InChI Key: SGLMCJZIPHJEIU-UHFFFAOYSA-N
    • SMILES: S1C(NC(NCCOC)=O)=NC=C1CN1CCC(C(C)C1)N

Computed Properties

  • Exact Mass: 327.17289623g/mol
  • Monoisotopic Mass: 327.17289623g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 6
  • Complexity: 360
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.1
  • Topological Polar Surface Area: 121?2

1-{5-[(4-Amino-3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl}-3-(2-methoxyethyl)urea Pricemore >>

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