338408-02-9
Product Name:
N-(3-CHLORO-2-METHYLPHENYL)-3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXAMIDE
Formula:
C16H12ClN5O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 357.75 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 357.0628670 g/mol |
| Monoisotopic Mass | 357.0628670 g/mol |
| Topological Polar Surface Area | 106 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 503 |
| 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 |