1090560-83-0
Product Name:
Benzoic acid, 2-[(4-thiazolylmethyl)thio]-, (3,4-dihydro-8-methyl-4-oxo-2-quinazolinyl)methyl ester
Formula:
C21H17N3O3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 423.5 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 423.07113376 g/mol |
| Monoisotopic Mass | 423.07113376 g/mol |
| Topological Polar Surface Area | 134 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 645 |
| 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 |