343374-08-3
Product Name:
4-BROMOPHENYL 2-[(4-METHYLBENZYL)SULFANYL]-5,6,7,8-TETRAHYDRO-4-QUINAZOLINYL SULFIDE
Formula:
C22H21BrN2S2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 457.5 g/mol |
|---|---|
| XLogP3 | 7.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 456.03295 g/mol |
| Monoisotopic Mass | 456.03295 g/mol |
| Topological Polar Surface Area | 76.4 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 450 |
| 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 |