5948-72-1
Product Name:
6-METHYL-2-OXO-4-THIOPHEN-2-YL-1,2,3,4-TETRAHYDRO-PYRIMIDINE-5-CARBOXYLIC ACID ETHYL ESTER
Formula:
C12H14N2O3S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >39.9 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 266.32 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 266.07251349 g/mol |
| Monoisotopic Mass | 266.07251349 g/mol |
| Topological Polar Surface Area | 95.7 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 395 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |