89813-88-7
Product Name:
1,5-Benzothiazepin-4(5H)-one, 2-(2-furanyl)-2,3-dihydro-
Formula:
C13H11NO2S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >36.8 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 245.30 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 245.05104977 g/mol |
| Monoisotopic Mass | 245.05104977 g/mol |
| Topological Polar Surface Area | 67.5 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 297 |
| 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 |