895869-90-6
Product Name:
N-[5-Chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl]-4-methyl-3-nitrobenzamide
Formula:
C23H17Cl2N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 454.3 g/mol |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 453.0646968 g/mol |
| Monoisotopic Mass | 453.0646968 g/mol |
| Topological Polar Surface Area | 98.7 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 698 |
| 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 |