N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2,5-dimethoxyaniline
Chemical Structure Depiction of
N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2,5-dimethoxyaniline
N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2,5-dimethoxyaniline
Compound characteristics
| Compound ID: | E958-2042 |
| Compound Name: | N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2,5-dimethoxyaniline |
| Molecular Weight: | 428.56 |
| Molecular Formula: | C21 H28 N6 O2 S |
| Smiles: | CCN1CCN(CC1)c1nnc(n2cccc2CNc2cc(ccc2OC)OC)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.423 |
| logD: | 2.5659 |
| logSw: | -3.6626 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.602 |
| InChI Key: | UKBRNUSWTUOBCL-UHFFFAOYSA-N |