1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | G731-0291 |
| Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-{[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 354.4 |
| Molecular Formula: | C18 H15 F N4 O S |
| Smiles: | C1CN(C(CSc2nnc(c3ccc(cc3)F)[nH]2)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.9889 |
| logD: | 1.7972 |
| logSw: | -3.4695 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.897 |
| InChI Key: | HRJDKULARHRCKF-UHFFFAOYSA-N |