383148-55-8
Product Name:
METHYL (E)-3-(1,3,4-THIADIAZOL-2-YLAMINO)-2-(1H-1,2,4-TRIAZOL-1-YL)-2-PROPENOATE
Formula:
C8H8N6O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 252.26 g/mol |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 252.04294469 g/mol |
| Monoisotopic Mass | 252.04294469 g/mol |
| Topological Polar Surface Area | 123 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 312 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |