1-(2,4-dimethoxyphenyl)-N-({1-[5-(4-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Chemical Structure Depiction of
1-(2,4-dimethoxyphenyl)-N-({1-[5-(4-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
1-(2,4-dimethoxyphenyl)-N-({1-[5-(4-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Compound characteristics
| Compound ID: | E958-0775 |
| Compound Name: | 1-(2,4-dimethoxyphenyl)-N-({1-[5-(4-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine |
| Molecular Weight: | 427.57 |
| Molecular Formula: | C22 H29 N5 O2 S |
| Smiles: | CC1CCN(CC1)c1nnc(n2cccc2CNCc2ccc(cc2OC)OC)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2913 |
| logD: | 4.2336 |
| logSw: | -4.2072 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.294 |
| InChI Key: | UJOVWSCQXABXIP-UHFFFAOYSA-N |