N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-1407 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide |
| Molecular Weight: | 319.47 |
| Molecular Formula: | C17 H25 N3 O S |
| Smiles: | CCCc1c(cnc(n1)SC)C(NCCC1CCCCC=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8431 |
| logD: | 3.8431 |
| logSw: | -3.7878 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.766 |
| InChI Key: | ZYQBUPMPYMJKHC-UHFFFAOYSA-N |