672925-49-4
Product Name:
2-(1-[(4-BROMOPHENYL)SULFONYL]-2-PYRROLIDINYL)-1,3-BENZOTHIAZOLE
Formula:
C17H15BrN2O2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 423.4 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 421.97583 g/mol |
| Monoisotopic Mass | 421.97583 g/mol |
| Topological Polar Surface Area | 86.9 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 545 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |