799795-34-9
Product Name:
6-[2-(benzylamino)-2-oxoethyl]sulfanyl-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide
Formula:
C29H28N4O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 528.6 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Exact Mass | 528.18312656 g/mol |
| Monoisotopic Mass | 528.18312656 g/mol |
| Topological Polar Surface Area | 142 Ų |
| Heavy Atom Count | 38 |
| Formal Charge | 0 |
| Complexity | 980 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |