309968-49-8
Product Name:
Benzamide, N-[[4-(2,5-dimethoxyphenyl)-5-[[2-[(4-fluorophenyl)amino]-2-oxoethyl]thio]-4H-1,2,4-triazol-3-yl]methyl]-4-(1-pyrrolidinylsulfonyl)-
Formula:
C30H31FN6O6S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 654.7 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 12 |
| Exact Mass | 654.17305324 g/mol |
| Monoisotopic Mass | 654.17305324 g/mol |
| Topological Polar Surface Area | 178 Ų |
| Heavy Atom Count | 45 |
| Formal Charge | 0 |
| Complexity | 1080 |
| 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 |