535945-34-7
Product Name:
5-[[[[(5-BROMO-1-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-2-CHLORO-BENZOIC ACID
Formula:
C19H12BrClN2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 463.7 g/mol |
|---|---|
| XLogP3 | 5.6 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 461.94405 g/mol |
| Monoisotopic Mass | 461.94405 g/mol |
| Topological Polar Surface Area | 111 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 593 |
| 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 |