919031-17-7
Product Name:
(2,3,7-Trimethyl-4,6-dioxo-4,5,6,7-tetrahydro-1,3a,5,7,8-pentaaza-cyclopenta[a]inden-1-yl)-acetic acid ethyl ester
Formula:
C14H17N5O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 319.32 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 319.12805404 g/mol |
| Monoisotopic Mass | 319.12805404 g/mol |
| Topological Polar Surface Area | 97.9 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 541 |
| 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 |