2-bromo-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)aniline
Chemical Structure Depiction of
2-bromo-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)aniline
2-bromo-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)aniline
Compound characteristics
| Compound ID: | E958-1983 |
| Compound Name: | 2-bromo-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)aniline |
| Molecular Weight: | 447.4 |
| Molecular Formula: | C19 H23 Br N6 S |
| Smiles: | CCN1CCN(CC1)c1nnc(n2cccc2CNc2ccccc2[Br])s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9918 |
| logD: | 3.1347 |
| logSw: | -3.9938 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.428 |
| InChI Key: | LJBWNZXHZZWPTA-UHFFFAOYSA-N |