591210-72-9
Product Name:
Benzoic acid, 5-[[[(2-benzofuranylcarbonyl)amino]thioxomethyl]amino]-2-chloro-, 1-methylethyl ester (9CI)
Formula:
C20H17ClN2O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 416.9 g/mol |
|---|---|
| XLogP3 | 5.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 416.0597559 g/mol |
| Monoisotopic Mass | 416.0597559 g/mol |
| Topological Polar Surface Area | 113 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 603 |
| 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 |