{1-ethyl-6-methyl-2-sulfanylidene-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidin-5-yl}(morpholin-4-yl)methanone
Chemical Structure Depiction of
{1-ethyl-6-methyl-2-sulfanylidene-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidin-5-yl}(morpholin-4-yl)methanone
{1-ethyl-6-methyl-2-sulfanylidene-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidin-5-yl}(morpholin-4-yl)methanone
Compound characteristics
| Compound ID: | V026-8984 |
| Compound Name: | {1-ethyl-6-methyl-2-sulfanylidene-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidin-5-yl}(morpholin-4-yl)methanone |
| Molecular Weight: | 413.46 |
| Molecular Formula: | C19 H22 F3 N3 O2 S |
| Salt: | not_available |
| Smiles: | CCN1C(C)=C(C(c2ccc(cc2)C(F)(F)F)NC1=S)C(N1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7167 |
| logD: | 2.7155 |
| logSw: | -2.938 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.028 |
| InChI Key: | PNJQKJFOYAURKZ-MRXNPFEDSA-N |