338407-90-2
Product Name:
N-(4-METHYLPHENYL)-3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXAMIDE
Formula:
C16H13N5O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 323.31 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 323.10183929 g/mol |
| Monoisotopic Mass | 323.10183929 g/mol |
| Topological Polar Surface Area | 106 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 461 |
| 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 |