861149-09-9
Product Name:
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[4-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-5-thiophen-2-yltriazole-4-carboxamide
Formula:
C18H15N9O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 453.4 g/mol |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 8 |
| Exact Mass | 453.09677117 g/mol |
| Monoisotopic Mass | 453.09677117 g/mol |
| Topological Polar Surface Area | 218 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 693 |
| 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 |