866149-16-8
Product Name:
1H-1,2,4-Triazole-1-butanoic acid, 4,5-dihydro-4-(3-methoxyphenyl)-3-methyl-5-oxo-
Formula:
C14H17N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 291.30 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 291.12190603 g/mol |
| Monoisotopic Mass | 291.12190603 g/mol |
| Topological Polar Surface Area | 82.4 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 438 |
| 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 |