374063-97-5
Product Name:
2-[4-(4-HYDROXYBUT-2-YNYL)PIPERAZIN-1-YL]-3-NITROBENZOIC ACID
Formula:
C15H17N3O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 319.31 g/mol |
|---|---|
| XLogP3 | -1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 319.11682065 g/mol |
| Monoisotopic Mass | 319.11682065 g/mol |
| Topological Polar Surface Area | 110 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 498 |
| 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 |