4363-99-9
Product Name:
(3-THIOPHEN-2-YLMETHYL-5-THIOXO-1,5-DIHYDRO-[1,2,4]TRIAZOL-4-YL)-ACETIC ACID
Formula:
C10H7NO4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 205.17 g/mol |
|---|---|
| XLogP3 | 0.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 205.03750770 g/mol |
| Monoisotopic Mass | 205.03750770 g/mol |
| Topological Polar Surface Area | 86.6 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 336 |
| 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 |