860784-23-2
Product Name:
5-METHYL-3-(2-THIENYL)-1,6-DIAZATRICYCLO[6.2.2.0(2,7)]DODECA-2(7),3,5-TRIENE-4-CARBONITRILE
Formula:
C16H15N3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 281.4 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 281.09866866 g/mol |
| Monoisotopic Mass | 281.09866866 g/mol |
| Topological Polar Surface Area | 68.2 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 423 |
| 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 |