337920-93-1
Product Name:
DIMETHYL 5-(4-BROMOPHENYL)-2-OXO-2,3-DIHYDRO-1H-2LAMBDA4-PYRROLO[1,2-C][1,3]THIAZOLE-6,7-DICARBOXYLATE
Formula:
C16H14BrNO5S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 412.3 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 410.97761 g/mol |
| Monoisotopic Mass | 410.97761 g/mol |
| Topological Polar Surface Area | 93.8 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 537 |
| 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 |