84916-38-1
Product Name:
Hexanoic acid, 1-((1,3,3a,4,7,7a-hexahydro-1,3-dioxo-2H-isoindol-2-yl) methyl)-2-(4-(2-pyridinyl)-1-piperazinyl)ethyl ester, (Z)-2-butenedioa te (1:2) -
Formula:
C26H36N4O4.2C4H4O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 700.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 15 |
| Rotatable Bond Count | 15 |
| Exact Mass | 700.29557285 g/mol |
| Monoisotopic Mass | 700.29557285 g/mol |
| Topological Polar Surface Area | 232 Ų |
| Heavy Atom Count | 50 |
| Formal Charge | 0 |
| Complexity | 842 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |