77563-08-7
Product Name:
6-(1-Methyl-2-(4-phenethylpiperazino)ethyl)-amino-2-isopropoxy-benzoth iazole oxalate hydrate
Formula:
C27H36N4O5S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 618.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 11 |
| Exact Mass | 618.23594998 g/mol |
| Monoisotopic Mass | 618.23594998 g/mol |
| Topological Polar Surface Area | 218 Ų |
| Heavy Atom Count | 43 |
| Formal Charge | 0 |
| Complexity | 593 |
| 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 | 3 |
| Compound Is Canonicalized | Yes |