78819-61-1
Product Name:
N-[5-OXO-1-(2,4,6-TRICHLOROPHENYL)-2-PYRAZOLIN-3-YL]-3-[2-(2,4-DI-T-PENTYLPHENOXY)HEXANAMIDO]BENZAMIDE
Formula:
C38H45Cl3N4O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 728.1 g/mol |
|---|---|
| XLogP3 | 11.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 14 |
| Exact Mass | 726.250639 g/mol |
| Monoisotopic Mass | 726.250639 g/mol |
| Topological Polar Surface Area | 100 Ų |
| Heavy Atom Count | 49 |
| Formal Charge | 0 |
| Complexity | 1170 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |