CP-744809
Basic information
- CAS
463976-07-0- Standard SMILES
Cc1c(S(=O)(=O)c2ccc(=O)[nH]n2)oc2ccc(Cl)cc12- InChIKey
FXFPQPNUMWQRAO-UHFFFAOYSA-N- Molecular formula
- C13H9ClN2O4S
- Average molar mass
- 324.74 g/mol
- Monoisotopic mass
- 323.9971556
Overview
has antidiabetic activity; structure in first source
Names & identifiers
- Preferred name
- CP-744809
- IUPAC
- 3-[(5-chloro-3-methyl-1-benzofuran-2-yl)sulfonyl]-1H-pyridazin-6-one
Names & synonyms
CP-744809463976-07-0ARI-8093(2H)-Pyridazinone, 6-((5-chloro-3-methyl-2-benzofuranyl)sulfonyl)-U63F8E95J16-(5-Chloro-3-methylbenzofuran-2-sulfonyl)-2H-pyridazin-3-one6-(5-Chloro-3-methylbenzofuran-2-ylsulfonyl)-2H-pyridazin-3-oneDTXSID701968286-CMeBzFSPORefChem:579361DTXCID101193196-((5-chloro-3-methyl-1-benzofuran-2-yl)sulfonyl)-2,3-dihydropyridazin-3-one
Show more names
6-[(5-CHLORO-3-METHYL-1-BENZOFURAN-2-YL)SULFONYL]PYRIDAZIN-3(2H)-ONE6-((5-chloro-3-methylbenzofuran-2-yl)sulfonyl)pyridazin-3(2H)-one3-[(5-chloro-3-methyl-1-benzofuran-2-yl)sulfonyl]-1H-pyridazin-6-oneCHEMBL24072562PUNII-U63F8E95J1FXFPQPNUMWQRAO-UHFFFAOYSA-Nbenzofuran, 24
Database identifiers
- CAS
463976-07-0- PubChem CID
- 6420118
- DTXSID
DTXSID70196828- ChEMBL
CHEMBL240725- UNII
- U63F8E95J1
- Nikkaji
- J2.282.363I
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 97.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 610
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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