1-[1-(2,5-dimethylphenyl)-6-methyl-4-(morpholin-4-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
Chemical Structure Depiction of
1-[1-(2,5-dimethylphenyl)-6-methyl-4-(morpholin-4-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
1-[1-(2,5-dimethylphenyl)-6-methyl-4-(morpholin-4-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8014-1845 |
| Compound Name: | 1-[1-(2,5-dimethylphenyl)-6-methyl-4-(morpholin-4-yl)-2-sulfanylidene-1,2-dihydropyrimidin-5-yl]ethan-1-one |
| Molecular Weight: | 357.47 |
| Molecular Formula: | C19 H23 N3 O2 S |
| Smiles: | CC1=C(C(=NC(N1c1cc(C)ccc1C)=S)N1CCOCC1)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.388 |
| logD: | 2.3366 |
| logSw: | -2.5242 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 34.301 |
| InChI Key: | BYWQLJTWFWUKFC-UHFFFAOYSA-N |