861630-76-4
Product Name:
N-(2-chloro-4,6-dimethylphenyl)-2-[[5-(phenoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Formula:
C22H23ClN4O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 443.0 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 9 |
| Exact Mass | 442.1230249 g/mol |
| Monoisotopic Mass | 442.1230249 g/mol |
| Topological Polar Surface Area | 94.3 Ų |
| Heavy Atom Count | 30 |
| 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 |