401822-62-6
Product Name:
methyl 3-{[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]methyl}benzoate
Formula:
C18H17NO3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 359.5 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 359.06498575 g/mol |
| Monoisotopic Mass | 359.06498575 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 423 |
| 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 |