21358-13-4
Product Name:
5-PHENOXYMETHYL-4-PHENYL-4H-[1,2,4]TRIAZOLE-3-THIOL
Formula:
C15H13N3OS
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COMPUTED DESCRIPTORS
Molecular Weight | 283.4 g/mol |
---|---|
XLogP3 | 3.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 283.07793322 g/mol |
Monoisotopic Mass | 283.07793322 g/mol |
Topological Polar Surface Area | 69 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 373 |
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 |