303059-16-7
Product Name:
methyl N-[(4-{2,9,13,15-tetraazatetracyclo[8.7.0.0^{3,8}.0^{12,16}]heptadeca-1,3(8),4,6,9,11,13,16-octaen-14-yl}phenyl)carbamothioyl]carbamate
Formula:
C22H16N6O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 428.5 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 428.10554495 g/mol |
| Monoisotopic Mass | 428.10554495 g/mol |
| Topological Polar Surface Area | 132 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 942 |
| 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 |