477292-16-3
Product Name:
(E)-3-(3-bromoanilino)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Formula:
C18H11BrN4O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 427.3 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 425.97861 g/mol |
| Monoisotopic Mass | 425.97861 g/mol |
| Topological Polar Surface Area | 123 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 588 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |