4-[1-(4-bromobenzene-1-sulfonyl)pyrrolidin-3-yl]-3-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
4-[1-(4-bromobenzene-1-sulfonyl)pyrrolidin-3-yl]-3-methyl-4H-1,2,4-triazole
4-[1-(4-bromobenzene-1-sulfonyl)pyrrolidin-3-yl]-3-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P944-4557 |
| Compound Name: | 4-[1-(4-bromobenzene-1-sulfonyl)pyrrolidin-3-yl]-3-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 371.25 |
| Molecular Formula: | C13 H15 Br N4 O2 S |
| Smiles: | Cc1nncn1C1CCN(C1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.59 |
| logD: | 1.59 |
| logSw: | -2.397 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.48 |
| InChI Key: | ICOGJTJWSYSBCO-GFCCVEGCSA-N |