40227-02-9
Product Name:
1-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-1,3-diphenylurea
Formula:
C17H16N2O3S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >49.3 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 328.4 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 328.08816355 g/mol |
| Monoisotopic Mass | 328.08816355 g/mol |
| Topological Polar Surface Area | 74.9 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 541 |
| 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 |