956917-85-4
Product Name:
(8S,8aR,11aS)-8-(4-methoxybenzoyl)-10-(2-methyl-5-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Formula:
C29H23N3O6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 509.5 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 509.15868546 g/mol |
| Monoisotopic Mass | 509.15868546 g/mol |
| Topological Polar Surface Area | 113 Ų |
| Heavy Atom Count | 38 |
| Formal Charge | 0 |
| Complexity | 1020 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |