1043384-17-3
Product Name:
ethyl 3-(3-amino-5-(benzylthio)-4-cyanothiophen-2-yl)-3-oxopropanoate
Formula:
C17H16N2O3S2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 360.5 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 360.06023472 g/mol |
| Monoisotopic Mass | 360.06023472 g/mol |
| Topological Polar Surface Area | 147 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 499 |
| 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 |