886497-15-0
Product Name:
4-BOC-AMINO-1-METHYL-1H-PYRROLE-2-CARBOXYLIC ACID 4-(2-OXO-2-PHENYL-ETHOXYCARBONYL)-BENZYL ESTER
Formula:
C27H28N2O7
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COMPUTED DESCRIPTORS
| Molecular Weight | 492.5 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 12 |
| Exact Mass | 492.18965124 g/mol |
| Monoisotopic Mass | 492.18965124 g/mol |
| Topological Polar Surface Area | 113 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 780 |
| 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 |