Pamidronate disodium

C3H9NNa2O7P2CAS 57248-88-1279.03 g/mol

H2NHOPO−O−OPOOHOHNa+Na+
AlcoholPhosphonatePrimary amine

Properties

Molecular formula
C3H9NNa2O7P2
Molar mass
279.03 g/mol
Exact mass
278.9650 Da
logP
-2.42Crippen estimate
Polar surface area
161.3 Ų
H-bond donors / acceptors
6 / 4
Rotatable bonds
4

Identifiers

CAS number
57248-88-1
SMILES
NCCC(O)(P([O-])([O-])=O)P(=O)(O)O.[Na+].[Na+]
InChIKey
JFDLEPOYGUTJNG-UHFFFAOYSA-N
InChI
InChI=1S/C3H11NO7P2.2Na/c4-2-1-3(5,12(6,7)8)13(9,10)11;;/h5H,1-2,4H2,(H2,6,7,8)(H2,9,10,11);;

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Names and synonyms

14 names · show all
  • Phosphonic acid, P,P′-(3-amino-1-hydroxypropylidene)bis-, sodium salt (1:2)
  • Phosphonic acid, (3-amino-1-hydroxypropylidene)bis-, disodium salt
  • 3-Amino-1-hydroxypropane-1,1-diphosphonic acid disodium salt
  • APD
  • Disodium 3-amino-1-hydroxypropane-1,1-diphosphonate
  • CGP 23339A
  • Disodium pamidronate
  • Aredia
  • CGP 23339AE
  • Aminomux
  • Pamidronic acid disodium salt
  • APD (pharmaceutical)
  • Disodium [3-amino-1-hydroxy-1-(hydroxy-oxidophosphoryl)propyl]-hydroxyphosphinate
  • Pamimed

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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