883031-66-1
Product Name:
N-(((2-(3,4-DIMETHOXYPHENYL)ETHYL)AMINO)THIOXOMETHYL)(3-(2-CHLOROPHENYL)-5-METHYLISOXAZOL-4-YL)FORMAMIDE
Formula:
C22H22ClN3O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 459.9 g/mol |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 459.1019551 g/mol |
| Monoisotopic Mass | 459.1019551 g/mol |
| Topological Polar Surface Area | 118 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 613 |
| 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 |