{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-bromofuran-2-yl)methanone
Chemical Structure Depiction of
{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-bromofuran-2-yl)methanone
{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-bromofuran-2-yl)methanone
Compound characteristics
| Compound ID: | SD73-0505 |
| Compound Name: | {2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-bromofuran-2-yl)methanone |
| Molecular Weight: | 429.31 |
| Molecular Formula: | C20 H21 Br N4 O2 |
| Smiles: | C1CC(CCc2nncn2Cc2ccccc2)N(C1)C(c1ccc(o1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9646 |
| logD: | 2.9646 |
| logSw: | -3.0981 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.886 |
| InChI Key: | HFRAWJPSBLUZGY-MRXNPFEDSA-N |