3-{[1-(3-methoxybenzene-1-sulfonyl)pyrrolidin-3-yl]methyl}-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[1-(3-methoxybenzene-1-sulfonyl)pyrrolidin-3-yl]methyl}-4-methyl-4H-1,2,4-triazole
3-{[1-(3-methoxybenzene-1-sulfonyl)pyrrolidin-3-yl]methyl}-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P936-2498 |
| Compound Name: | 3-{[1-(3-methoxybenzene-1-sulfonyl)pyrrolidin-3-yl]methyl}-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 336.41 |
| Molecular Formula: | C15 H20 N4 O3 S |
| Smiles: | Cn1cnnc1CC1CCN(C1)S(c1cccc(c1)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2546 |
| logD: | 1.2545 |
| logSw: | -2.3395 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.681 |
| InChI Key: | KMQJRGCEHMUOQT-LBPRGKRZSA-N |