[4-({[4-(4-fluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[4-({[4-(4-fluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[4-({[4-(4-fluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V027-6576 |
| Compound Name: | [4-({[4-(4-fluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C22 H23 F N4 O2 S |
| Salt: | not_available |
| Smiles: | COCc1nnc(n1c1ccc(cc1)F)SCc1ccc(cc1)C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5375 |
| logD: | 2.5375 |
| logSw: | -2.5753 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.398 |
| InChI Key: | PMJDODQKBBRPLZ-UHFFFAOYSA-N |