339098-72-5
Product Name:
3-ACETYL-4,5-BIS(HYDROXYMETHYL)-4,5-DIHYDROISOXAZOLE-N-(4-NITOPHENYL)PIPERID-4-ONE ACETAL
Formula:
C18H21N3O6
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COMPUTED DESCRIPTORS
| Molecular Weight | 375.4 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 375.14303540 g/mol |
| Monoisotopic Mass | 375.14303540 g/mol |
| Topological Polar Surface Area | 106 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 617 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |