CHEMBL1738792

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 5
Total Number of Articles : 6
PubChem 51035423
Molecular Formula

C12H13ClN6O4S

SMILES

COC(=O)CNC1=NC(=NC(=N1)Cl)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C12H13ClN6O4S/c1-23-9(20)6-15-11-17-10(13)18-12(19-11)16-7-2-4-8(5-3-7)24(14,21)22/h2-5H,6H2,1H3,(H2,14,21,22)(H2,15,16,17,18,19)

synonyms
  • CHEMBL1738792
  • Methyl N-{4-Chloro-6-[(4-Sulfamoylphenyl)amino]-1,3,5-Triazin-2-Yl}glycinate
  • 3mna
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Properties
Property Value
MW 372.79 g/mol
HBD 3
HBA 10
Rotatable Bond Count 7
Exact Mass 372.0407518 g/mol
Monoisotopic Mass 372.0407518 g/mol
Heavy Atom Count 24
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 522
xlogp 1.6
Topological Polar Surface Area 158