yh239

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 2
Total Number of Articles : 1
PubChem 60156286
Molecular Formula

C23H23Cl2N3O4

SMILES

CC(C)(C)NC(=O)[C@H](C1=C(NC2=C1C=CC(=C2)Cl)C(=O)O)N(CC3=CC=C(C=C3)Cl)C=O

InChI

InChI=1S/C23H23Cl2N3O4/c1-23(2,3)27-21(30)20(28(12-29)11-13-4-6-14(24)7-5-13)18-16-9-8-15(25)10-17(16)26-19(18)22(31)32/h4-10,12,20,26H,11H2,1-3H3,(H,27,30)(H,31,32)/t20-/m0/s1

synonyms
  • CHEMBL4566706
  • 3-{(1s)-2-(Tert-Butylamino)-1-[(4-Chlorobenzyl)(Formyl)amino]-2-Oxoethyl}-6-Chloro-1h-Indole-2-Carboxylic Acid
  • GLXC-26417
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Properties
Property Value
MW 476.3 g/mol
HBD 3
HBA 4
Rotatable Bond Count 7
Exact Mass 475.1065616 g/mol
Monoisotopic Mass 475.1065616 g/mol
Heavy Atom Count 32
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 693
xlogp 4.5
Topological Polar Surface Area 103