924116-79-0
Product Name:
2-Thiophenecarboxylic acid, 3-[(3,4-dihydro-2(1H)-isoquinolinyl)sulfonyl]-
Formula:
C14H13NO4S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 323.4 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 323.02860024 g/mol |
| Monoisotopic Mass | 323.02860024 g/mol |
| Topological Polar Surface Area | 111 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 502 |
| 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 |