2-(butylsulfanyl)-6-methyl-5-[2-(2-methylphenoxy)ethyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(butylsulfanyl)-6-methyl-5-[2-(2-methylphenoxy)ethyl]pyrimidin-4(3H)-one
2-(butylsulfanyl)-6-methyl-5-[2-(2-methylphenoxy)ethyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8016-7579 |
| Compound Name: | 2-(butylsulfanyl)-6-methyl-5-[2-(2-methylphenoxy)ethyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 332.46 |
| Molecular Formula: | C18 H24 N2 O2 S |
| Smiles: | CCCCSC1NC(C(CCOc2ccccc2C)=C(C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5592 |
| logD: | 4.3295 |
| logSw: | -4.3447 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.657 |
| InChI Key: | VEVINHOGMCUREH-UHFFFAOYSA-N |