339028-63-6
Product Name:
DIETHYL 2-(([4-BENZOYL-1-(2,4-DICHLOROBENZYL)-5-METHYL-1H-PYRROL-3-YL]AMINO)METHYLENE)MALONATE
Formula:
C27H26Cl2N2O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 529.4 g/mol |
|---|---|
| XLogP3 | 6.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 12 |
| Exact Mass | 528.1218773 g/mol |
| Monoisotopic Mass | 528.1218773 g/mol |
| Topological Polar Surface Area | 86.6 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 781 |
| 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 |