5-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methoxyaniline
Chemical Structure Depiction of
5-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methoxyaniline
5-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methoxyaniline
Compound characteristics
| Compound ID: | E958-2085 |
| Compound Name: | 5-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methoxyaniline |
| Molecular Weight: | 432.97 |
| Molecular Formula: | C20 H25 Cl N6 O S |
| Smiles: | CCN1CCN(CC1)c1nnc(n2cccc2CNc2cc(ccc2OC)[Cl])s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9925 |
| logD: | 3.1353 |
| logSw: | -4.3633 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.058 |
| InChI Key: | XFGGRSNUXHCTLG-UHFFFAOYSA-N |