95633-33-3
Product Name:
(5,6-DIPHENYL-[1,2,4]TRIAZIN-3-YLSULFANYL)-ACETIC ACID
Formula:
C17H13N3O2S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 19.2 [ug/mL] (The mean of the results at pH 7.4) |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 323.4 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 323.07284784 g/mol |
| Monoisotopic Mass | 323.07284784 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 384 |
| 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 |