314282-77-4
Product Name:
3-(3-CYANO-5,6-DIHYDRO-4 H-CYCLOPENTA[ B ]THIOPHEN-2-YLCARBAMOYL)-ACRYLIC ACID
Formula:
C12H10N2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 262.29 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 262.04121336 g/mol |
| Monoisotopic Mass | 262.04121336 g/mol |
| Topological Polar Surface Area | 118 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 440 |
| 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 |