708290-08-8
Product Name:
dimethyl 5-(3-(4-morpholinophenyl)thioureido)isophthalate
Formula:
C21H23N3O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 429.5 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 429.13584202 g/mol |
| Monoisotopic Mass | 429.13584202 g/mol |
| Topological Polar Surface Area | 121 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 581 |
| 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 |