4-(propan-2-yl)-3-{[1-(thiophene-2-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(propan-2-yl)-3-{[1-(thiophene-2-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
4-(propan-2-yl)-3-{[1-(thiophene-2-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P936-1161 |
| Compound Name: | 4-(propan-2-yl)-3-{[1-(thiophene-2-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole |
| Molecular Weight: | 340.46 |
| Molecular Formula: | C14 H20 N4 O2 S2 |
| Smiles: | CC(C)n1cnnc1CC1CCN(C1)S(c1cccs1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7897 |
| logD: | 1.7884 |
| logSw: | -2.368 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.391 |
| InChI Key: | WCMYSCKDKISEIB-LBPRGKRZSA-N |