3-[(2S)-1-(5-chlorothiophene-2-sulfonyl)pyrrolidin-2-yl]-5-ethyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[(2S)-1-(5-chlorothiophene-2-sulfonyl)pyrrolidin-2-yl]-5-ethyl-4H-1,2,4-triazole
3-[(2S)-1-(5-chlorothiophene-2-sulfonyl)pyrrolidin-2-yl]-5-ethyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P930-2235 |
| Compound Name: | 3-[(2S)-1-(5-chlorothiophene-2-sulfonyl)pyrrolidin-2-yl]-5-ethyl-4H-1,2,4-triazole |
| Molecular Weight: | 346.85 |
| Molecular Formula: | C12 H15 Cl N4 O2 S2 |
| Smiles: | CCc1nnc([C@@H]2CCCN2S(c2ccc(s2)[Cl])(=O)=O)[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 1.91 |
| logD: | 1.9053 |
| logSw: | -2.7997 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.58 |
| InChI Key: | QHRGOJKJEZOPDE-QMMMGPOBSA-N |