N,N-diethyl-2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N,N-diethyl-2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N,N-diethyl-2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | V015-9650 |
| Compound Name: | N,N-diethyl-2-{[5-(4-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 348.44 |
| Molecular Formula: | C17 H21 F N4 O S |
| Salt: | not_available |
| Smiles: | CCN(CC)C(CSc1nnc(c2ccc(cc2)F)n1CC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2137 |
| logD: | 3.2137 |
| logSw: | -3.2467 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.895 |
| InChI Key: | NOPDMQBKHOQUFC-UHFFFAOYSA-N |