324548-14-3
Product Name:
3H-Pyrazol-3-one,5-ethoxy-2,4-dihydro-4-[(5-methyl-1H-pyrrol-2-yl)methylene]-(9CI)
Formula:
C11H13N3O2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 219.24 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 219.100776666 g/mol |
| Monoisotopic Mass | 219.100776666 g/mol |
| Topological Polar Surface Area | 66.5 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 349 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |