329701-66-8
Product Name:
2-[(4-BROMOPHENYL)SULFONYL]-4-BUTYL-5-PHENYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
Formula:
C18H18BrN3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 436.3 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 435.02523 g/mol |
| Monoisotopic Mass | 435.02523 g/mol |
| Topological Polar Surface Area | 78.4 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 633 |
| 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 |