477853-60-4
Product Name:
METHYL 3-((2-CYANO-3-[(ETHOXYCARBONYL)AMINO]-3-OXO-1-PROPENYL)AMINO)-2-THIOPHENECARBOXYLATE
Formula:
C13H13N3O5S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 323.33 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 323.05759170 g/mol |
| Monoisotopic Mass | 323.05759170 g/mol |
| Topological Polar Surface Area | 146 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 525 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |