85459-86-5
Product Name:
2-amino-4-(5-iodofuran-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
Formula:
C16H15IN2O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 410.21 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 410.01274 g/mol |
| Monoisotopic Mass | 410.01274 g/mol |
| Topological Polar Surface Area | 89.2 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 641 |
| 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 |