2098117-51-0
Product Name:
Pyrrolo[3,4-c]pyrrole-2,3a(1H,4H)-dicarboxylic acid, tetrahydro-5-(phenylmethyl)-, 2-(1,1-dimethylethyl) 3a-methyl ester
Formula:
C20H28N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 360.4 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 360.20490738 g/mol |
| Monoisotopic Mass | 360.20490738 g/mol |
| Topological Polar Surface Area | 59.1 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 538 |
| 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 |