868255-45-2
Product Name:
4-(4-BROMOPHENYL)-2-[(4-METHYLPHENYL)SULFANYL]-4-OXOBUTANOIC ACID
Formula:
C17H15BrO3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 379.3 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 377.99253 g/mol |
| Monoisotopic Mass | 377.99253 g/mol |
| Topological Polar Surface Area | 79.7 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 385 |
| 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 |