[2-({[4-(4-fluorophenyl)-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[2-({[4-(4-fluorophenyl)-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[2-({[4-(4-fluorophenyl)-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V026-7454 |
| Compound Name: | [2-({[4-(4-fluorophenyl)-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C23 H25 F N4 O S |
| Salt: | not_available |
| Smiles: | CC(C)c1nnc(n1c1ccc(cc1)F)SCc1ccccc1C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5615 |
| logD: | 4.5615 |
| logSw: | -4.3727 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.998 |
| InChI Key: | MQCJHWPRBKXMPZ-UHFFFAOYSA-N |