318284-65-0
Product Name:
1-METHYL-5-[(2-METHYLBENZYL)SULFONYL]-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBONITRILE
Formula:
C14H12F3N3O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 343.33 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 343.06023229 g/mol |
| Monoisotopic Mass | 343.06023229 g/mol |
| Topological Polar Surface Area | 84.1 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 578 |
| 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 |