879472-68-1
Product Name:
1-sec-Butyl-2,3,7-trimethyl-1H,7H-1,3a,5,7,8-pentaaza-cyclopenta[a]indene-4,6-dione
Formula:
C14H19N5O2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 289.33 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 289.15387487 g/mol |
| Monoisotopic Mass | 289.15387487 g/mol |
| Topological Polar Surface Area | 71.6 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 470 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |