478065-04-2
Product Name:
ETHYL 4-(3-[(4-CHLOROBENZOYL)AMINO]PHENOXY)-2-(METHYLSULFANYL)-5-PYRIMIDINECARBOXYLATE
Formula:
C21H18ClN3O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 443.9 g/mol |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 443.0706549 g/mol |
| Monoisotopic Mass | 443.0706549 g/mol |
| Topological Polar Surface Area | 116 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 577 |
| 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 |