34719-10-3
Product Name:
2-[(5-(AMINOCARBONYL)-3-([3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE]METHYL)-2-CYCLOHEXEN-1-YLIDENE)METHYL]-3-ETHYL-1,3-BENZOTHIAZOL-3-IUM IODIDE
Formula:
C27H28IN3OS2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 601.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 601.07185 g/mol |
| Monoisotopic Mass | 601.07185 g/mol |
| Topological Polar Surface Area | 104 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 779 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |