497082-11-8
Product Name:
ethyl 4-[[2-[(1-amino-7,8-dihydro-6H-cyclopenta[4,5]thieno[1,2-c]pyrimidin-3-yl)sulfanyl]acetyl]amino]benzoate
Formula:
C20H20N4O3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 428.5 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 428.09768286 g/mol |
| Monoisotopic Mass | 428.09768286 g/mol |
| Topological Polar Surface Area | 161 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 602 |
| 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 |