2059974-57-9
Product Name:
7-Oxa-3-azabicyclo[4.1.0]heptane-3-carboxylic acid, 6-(1-methyl-1H-pyrrol-2-yl)-, phenylmethyl ester
Formula:
C18H20N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 312.4 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 312.14739250 g/mol |
| Monoisotopic Mass | 312.14739250 g/mol |
| Topological Polar Surface Area | 47 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 452 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |