3,4-dimethoxy-N-({1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)aniline
Chemical Structure Depiction of
3,4-dimethoxy-N-({1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)aniline
3,4-dimethoxy-N-({1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)aniline
Compound characteristics
| Compound ID: | E958-1284 |
| Compound Name: | 3,4-dimethoxy-N-({1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)aniline |
| Molecular Weight: | 399.51 |
| Molecular Formula: | C20 H25 N5 O2 S |
| Smiles: | COc1ccc(cc1OC)NCc1cccn1c1nnc(N2CCCCC2)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.7514 |
| logD: | 3.7514 |
| logSw: | -3.9087 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.85 |
| InChI Key: | JKFYUEQIAQUCAM-UHFFFAOYSA-N |