477862-27-4
Product Name:
4-[4-(2-THIENYL)-2-PYRIMIDINYL]PHENYL 4-(ACETYLAMINO)BENZENESULFONATE
Formula:
C22H17N3O4S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 451.5 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 451.06604838 g/mol |
| Monoisotopic Mass | 451.06604838 g/mol |
| Topological Polar Surface Area | 135 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 698 |
| 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 |