6-ethyl-2-(ethylsulfanyl)-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-ethyl-2-(ethylsulfanyl)-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
6-ethyl-2-(ethylsulfanyl)-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-1174 |
| Compound Name: | 6-ethyl-2-(ethylsulfanyl)-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 302.44 |
| Molecular Formula: | C17 H22 N2 O S |
| Salt: | not_available |
| Smiles: | CCC1=C(Cc2cccc(C)c2)C(N(C)C(=N1)SCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0719 |
| logD: | 4.0719 |
| logSw: | -4.0196 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.0667 |
| InChI Key: | AAQVVKGIBBKJHU-UHFFFAOYSA-N |