{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-methylthiophen-2-yl)methanone
Chemical Structure Depiction of
{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-methylthiophen-2-yl)methanone
{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-methylthiophen-2-yl)methanone
Compound characteristics
| Compound ID: | SD73-0536 |
| Compound Name: | {2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-methylthiophen-2-yl)methanone |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C21 H24 N4 O S |
| Smiles: | Cc1ccc(C(N2CCCC2CCc2nncn2Cc2ccccc2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4658 |
| logD: | 3.4658 |
| logSw: | -3.6134 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.978 |
| InChI Key: | VHGUIDHPPWCAER-GOSISDBHSA-N |