2-{[5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one
2-{[5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | V014-1840 |
| Compound Name: | 2-{[5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one |
| Molecular Weight: | 362.42 |
| Molecular Formula: | C17 H19 F N4 O2 S |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2ccccc2F)nnc1SCC(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9174 |
| logD: | 1.9174 |
| logSw: | -2.5233 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.52 |
| InChI Key: | ILIYMXVQCJQVDP-UHFFFAOYSA-N |