1-{4-[4-(diethylamino)phenyl]-1-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(diethylamino)phenyl]-1-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethan-1-one
1-{4-[4-(diethylamino)phenyl]-1-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethan-1-one
Compound characteristics
| Compound ID: | 5868-0126 |
| Compound Name: | 1-{4-[4-(diethylamino)phenyl]-1-phenyl-5-(thiophen-2-yl)-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethan-1-one |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | CCN(CC)c1ccc(cc1)N1C(c2cccs2)N(c2ccccc2)N=C1C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3628 |
| logD: | 5.3093 |
| logSw: | -5.3278 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.438 |
| InChI Key: | GDWFDWSGXBBQTQ-DEOSSOPVSA-N |