338794-42-6
Product Name:
N-[(4-ALLYL-5-([4-(TERT-BUTYL)BENZYL]SULFANYL)-4H-1,2,4-TRIAZOL-3-YL)METHYL]-4-BROMOBENZENESULFONAMIDE
Formula:
C23H27BrN4O2S2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 535.5 g/mol |
|---|---|
| XLogP3 | 5.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 10 |
| Exact Mass | 534.07588 g/mol |
| Monoisotopic Mass | 534.07588 g/mol |
| Topological Polar Surface Area | 111 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 694 |
| 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 |