[2-({[4-benzyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[2-({[4-benzyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[2-({[4-benzyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V030-1438 |
| Compound Name: | [2-({[4-benzyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 460.62 |
| Molecular Formula: | C25 H24 N4 O S2 |
| Salt: | not_available |
| Smiles: | C1CCN(C1)C(c1ccccc1CSc1nnc(c2cccs2)n1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2985 |
| logD: | 5.2985 |
| logSw: | -5.4522 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.002 |
| InChI Key: | PPYUANFLNXIXMN-UHFFFAOYSA-N |