338395-74-7
Product Name:
2-(3-([(4-Chlorophenyl)sulfanyl]methyl)-1H-1,2,4-triazol-5-yl)acetonitrile
Formula:
C11H9ClN4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 264.73 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 264.0236452 g/mol |
| Monoisotopic Mass | 264.0236452 g/mol |
| Topological Polar Surface Area | 90.7 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 284 |
| 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 |