919012-68-3
Product Name:
1-(2-Chloro-ethyl)-2,3,7-trimethyl-5-propyl-1H,7H-1,3a,5,7,8-pentaaza-cyclopenta[a]indene-4,6-dione
Formula:
C15H20ClN5O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 337.80 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 337.1305526 g/mol |
| Monoisotopic Mass | 337.1305526 g/mol |
| Topological Polar Surface Area | 62.8 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 504 |
| 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 |