[2-({[4-(4-methoxyphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[2-({[4-(4-methoxyphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[2-({[4-(4-methoxyphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V029-7988 |
| Compound Name: | [2-({[4-(4-methoxyphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C25 H24 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)n1c(c2cccs2)nnc1SCc1ccccc1C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0749 |
| logD: | 5.0749 |
| logSw: | -4.6996 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.289 |
| InChI Key: | VGFNDCOJTXAXQD-UHFFFAOYSA-N |