4-benzyl-3-{[1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-benzyl-3-{[1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
4-benzyl-3-{[1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P936-3577 |
| Compound Name: | 4-benzyl-3-{[1-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole |
| Molecular Weight: | 401.49 |
| Molecular Formula: | C19 H23 N5 O3 S |
| Smiles: | Cc1c(c(C)on1)S(N1CCC(Cc2nncn2Cc2ccccc2)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5217 |
| logD: | 1.5217 |
| logSw: | -2.2876 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.348 |
| InChI Key: | QKIGVDZBVQLUFW-KRWDZBQOSA-N |