920750-80-7
Product Name:
4-Isoxazolecarboxylic acid, 5-[(butylamino)carbonyl]-3-[[(2,5-dimethylphenyl)thio]methyl]-
Formula:
C18H22N2O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 362.4 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 8 |
| Exact Mass | 362.13002836 g/mol |
| Monoisotopic Mass | 362.13002836 g/mol |
| Topological Polar Surface Area | 118 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 462 |
| 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 |