66144-20-5
Product Name:
1H-Pyrrole-2-acetic acid, α-acetyl-1-(3,5-dimethylphenyl)-4-(ethoxycarbonyl)-2,3-dihydro-3-hydroxy-5-methyl-3-(4-nitrophenyl)-, ethyl ester
Formula:
C28H32N2O8
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COMPUTED DESCRIPTORS
| Molecular Weight | 524.6 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 10 |
| Exact Mass | 524.21586598 g/mol |
| Monoisotopic Mass | 524.21586598 g/mol |
| Topological Polar Surface Area | 139 Ų |
| Heavy Atom Count | 38 |
| Formal Charge | 0 |
| Complexity | 941 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |