337920-31-7
Product Name:
ETHYL 4-([3-(4-CHLOROPHENYL)-2,1-BENZISOXAZOL-5-YL]CARBONYL)-3-ISOXAZOLECARBOXYLATE
Formula:
C20H13ClN2O5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 396.8 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 396.0512992 g/mol |
| Monoisotopic Mass | 396.0512992 g/mol |
| Topological Polar Surface Area | 95.4 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 583 |
| 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 |