{3-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-5-methylthiophen-2-yl]-1,2,4-oxadiazol-5-yl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{3-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-5-methylthiophen-2-yl]-1,2,4-oxadiazol-5-yl}(pyrrolidin-1-yl)methanone
{3-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-5-methylthiophen-2-yl]-1,2,4-oxadiazol-5-yl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | L824-0086 |
| Compound Name: | {3-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-5-methylthiophen-2-yl]-1,2,4-oxadiazol-5-yl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C21 H22 N4 O4 S2 |
| Smiles: | Cc1c(cc(c2nc(C(N3CCCC3)=O)on2)s1)S(N1CCc2ccccc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8063 |
| logD: | 3.8063 |
| logSw: | -3.7982 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.321 |
| InChI Key: | GWZAIBOLCWYGQF-UHFFFAOYSA-N |