sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride

C10H11ClN2NaO6PS — CID 173131583

IUPACsodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride
SMILESO=P(O)(CNS(=O)(=O)c1ccoc1)Oc1cccnc1Cl.[H-].[Na+]
InChIInChI=1S/C10H10ClN2O6PS.Na.H/c11-10-9(2-1-4-12-10)19-20(14,15)7-13-21(16,17)8-3-5-18-6-8;;/h1-6,13H,7H2,(H,14,15);;/q;+1;-1
InChIKeyTXDLYGLYYRYJSS-UHFFFAOYSA-N
MW376.69 g/mol
LogP-1.06
Rot. Bonds6

About sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride

sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride (PubChem CID 173131583) has the molecular formula C10H11ClN2NaO6PS and a molecular weight of 376.69 g/mol. Its IUPAC name is sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride.

Molecular Properties

Compound Namesodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride
PubChem CID173131583
Molecular FormulaC10H11ClN2NaO6PS
Molecular Weight376.69 g/mol
Exact Mass375.97
IUPAC Namesodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride
SMILESO=P(O)(CNS(=O)(=O)c1ccoc1)Oc1cccnc1Cl.[H-].[Na+]
InChIInChI=1S/C10H10ClN2O6PS.Na.H/c11-10-9(2-1-4-12-10)19-20(14,15)7-13-21(16,17)8-3-5-18-6-8;;/h1-6,13H,7H2,(H,14,15);;/q;+1;-1
InChIKeyTXDLYGLYYRYJSS-UHFFFAOYSA-N
XLogP-1.06
TPSA118.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.69
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-chloro-3-pyridinyl)oxy-[[[3-(phenylcarbamoylamino)phenyl]sulfonylamino]methyl]phosphinic acid
CID 87667904
(2-chloro-3-pyridinyl)oxy-[(isoquinolin-5-ylsulfonylamino)methyl]phosphinic acid
CID 87667775
sodium (2-bromo-3-pyridinyl)oxy-[[(4-fluorophenyl)sulfonylamino]methyl]phosphinate
CID 23703554
(2-chloro-3-pyridinyl) trifluoromethanesulfonate
CID 10967281
ethyl 3-[(2-chloro-3-pyridinyl)sulfonylamino]propanoate
CID 55207055
2-chloro-N-(furan-3-ylmethyl)pyridin-3-amine
CID 63204400
2-chloro-N-[(2-methoxyphenyl)methyl]pyridine-3-sulfonamide
CID 43414928
N-(benzenesulfonyl)-2-chloropyridine-3-carboxamide
CID 57401428
lithium;2-chloropyridine-3-sulfonic acid;hydride
CID 173107701
2-chloro-3-(methoxymethoxy)pyridine
CID 57430080
(2-chloro-3-pyridinyl) 2-hydroxypropanoate
CID 131201350
N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]furan-3-carboxamide
CID 674488

Frequently Asked Questions

What is the IUPAC name of sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride?
The IUPAC name of sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride (CID 173131583) is sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride.
What is the SMILES notation for sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride?
The canonical SMILES for sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride is O=P(O)(CNS(=O)(=O)c1ccoc1)Oc1cccnc1Cl.[H-].[Na+].
What is the InChIKey of sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride?
The InChIKey is TXDLYGLYYRYJSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN2O6PS.Na.H/c11-10-9(2-1-4-12-10)19-20(14,15)7-13-21(16,17)8-3-5-18-6-8;;/h1-6,13H,7H2,(H,14,15);;/q;+1;-1.
What are the key properties of sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride?
sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride has a molecular weight of 376.69 g/mol, XLogP of -1.06, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;(2-chloro-3-pyridinyl)oxy-[(furan-3-ylsulfonylamino)methyl]phosphinic acid;hydride is sourced from PubChem (CID 173131583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).