4-ethyl-3-{[1-(thiophene-2-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-ethyl-3-{[1-(thiophene-2-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
4-ethyl-3-{[1-(thiophene-2-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P936-0815 |
| Compound Name: | 4-ethyl-3-{[1-(thiophene-2-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole |
| Molecular Weight: | 326.44 |
| Molecular Formula: | C13 H18 N4 O2 S2 |
| Smiles: | CCn1cnnc1CC1CCN(C1)S(c1cccs1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1951 |
| logD: | 1.1947 |
| logSw: | -2.204 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.324 |
| InChI Key: | VMLKMBHEBNGYHH-NSHDSACASA-N |