929849-57-0
Product Name:
2-[[4-(8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-ylidene)piperidine-1-carbonyl]amino]acetic acid
Formula:
C22H22ClN3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 411.9 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 411.1349693 g/mol |
| Monoisotopic Mass | 411.1349693 g/mol |
| Topological Polar Surface Area | 82.5 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 658 |
| 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 |