ethyl 4-amino-2-({2-oxo-2-[phenyl(prop-2-en-1-yl)amino]ethyl}sulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-({2-oxo-2-[phenyl(prop-2-en-1-yl)amino]ethyl}sulfanyl)pyrimidine-5-carboxylate
ethyl 4-amino-2-({2-oxo-2-[phenyl(prop-2-en-1-yl)amino]ethyl}sulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0027 |
| Compound Name: | ethyl 4-amino-2-({2-oxo-2-[phenyl(prop-2-en-1-yl)amino]ethyl}sulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 372.44 |
| Molecular Formula: | C18 H20 N4 O3 S |
| Smiles: | CCOC(c1cnc(nc1N)SCC(N(CC=C)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7902 |
| logD: | 2.7902 |
| logSw: | -3.1683 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.577 |
| InChI Key: | KZYNQZLYFSSEQM-UHFFFAOYSA-N |