337487-21-5
Product Name:
[5-(3,4-DIMETHOXY-PHENYL)-4-ETHYL-4 H-[1,2,4]TRIAZOL-3-YLSULFANYL]-ACETIC ACID
Formula:
C14H17N3O4S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 323.37 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 323.09397721 g/mol |
| Monoisotopic Mass | 323.09397721 g/mol |
| Topological Polar Surface Area | 112 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 374 |
| 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 |