1-(2,3-dimethylphenyl)-4-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)piperazine
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-4-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)piperazine
1-(2,3-dimethylphenyl)-4-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)piperazine
Compound characteristics
| Compound ID: | E958-2027 |
| Compound Name: | 1-(2,3-dimethylphenyl)-4-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)piperazine |
| Molecular Weight: | 465.66 |
| Molecular Formula: | C25 H35 N7 S |
| Smiles: | CCN1CCN(CC1)c1nnc(n2cccc2CN2CCN(CC2)c2cccc(C)c2C)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3845 |
| logD: | 3.5274 |
| logSw: | -4.1489 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.583 |
| InChI Key: | ZQIYNXOPEIUFSL-UHFFFAOYSA-N |