4-benzyl-3-{[1-(2,3-dihydro-1H-indene-5-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-benzyl-3-{[1-(2,3-dihydro-1H-indene-5-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
4-benzyl-3-{[1-(2,3-dihydro-1H-indene-5-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P936-3578 |
| Compound Name: | 4-benzyl-3-{[1-(2,3-dihydro-1H-indene-5-sulfonyl)pyrrolidin-3-yl]methyl}-4H-1,2,4-triazole |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | C1Cc2ccc(cc2C1)S(N1CCC(Cc2nncn2Cc2ccccc2)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7524 |
| logD: | 3.7524 |
| logSw: | -4.09 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.596 |
| InChI Key: | XPVVJJZNCQOADG-IBGZPJMESA-N |