N-(3-ethoxypropyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(3-ethoxypropyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-(3-ethoxypropyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0450 |
| Compound Name: | N-(3-ethoxypropyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 331.43 |
| Molecular Formula: | C17 H21 N3 O2 S |
| Smiles: | CCOCCCNC(c1cnc(nc1c1ccccc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8582 |
| logD: | 2.8582 |
| logSw: | -3.3269 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.056 |
| InChI Key: | KOQBHCFDODMTOD-UHFFFAOYSA-N |