3-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methylaniline
Chemical Structure Depiction of
3-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methylaniline
3-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methylaniline
Compound characteristics
| Compound ID: | E958-2032 |
| Compound Name: | 3-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methylaniline |
| Molecular Weight: | 416.97 |
| Molecular Formula: | C20 H25 Cl N6 S |
| Smiles: | CCN1CCN(CC1)c1nnc(n2cccc2CNc2cccc(c2C)[Cl])s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5534 |
| logD: | 3.6963 |
| logSw: | -4.4829 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.428 |
| InChI Key: | PMHXDNRYDVBIRL-UHFFFAOYSA-N |