664966-03-4
Product Name:
1-[2-(2,4-DICHLOROPHENOXY)PHENYL]-5-PHENYL-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
Formula:
C21H13Cl2N3O3
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 426.2 g/mol |
---|---|
XLogP3 | 5.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 5 |
Exact Mass | 425.0333967 g/mol |
Monoisotopic Mass | 425.0333967 g/mol |
Topological Polar Surface Area | 77.2 Ų |
Heavy Atom Count | 29 |
Formal Charge | 0 |
Complexity | 563 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |