933701-95-2
Product Name:
3H-1,2,4-Triazol-3-one, 1,2-dihydro-5-(2-piperidinyl)-
Formula:
C7H12N4O
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COMPUTED DESCRIPTORS
| Molecular Weight | 168.20 g/mol |
|---|---|
| XLogP3 | -0.3 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 168.10111102 g/mol |
| Monoisotopic Mass | 168.10111102 g/mol |
| Topological Polar Surface Area | 65.5 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 225 |
| 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 |