956818-54-5
Product Name:
(2R)-2-(2-((11aS)-5-(3-chlorophenyl)-1,3-dioxo-11,11a-dihydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H,5H,6H)-yl)benzamido)propanoic acid
Formula:
C29H23ClN4O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 543.0 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 542.1356975 g/mol |
| Monoisotopic Mass | 542.1356975 g/mol |
| Topological Polar Surface Area | 123 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 1010 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |