4-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
4-chloro-N-({1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-methylaniline
4-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: | E958-1991 |
| Compound Name: | 4-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(n2cccc2CNc2ccc(cc2C)[Cl])s1 |
| Stereo: | ACHIRAL |
| logP: | 4.6652 |
| logD: | 3.8081 |
| logSw: | -4.6449 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.428 |
| InChI Key: | KBMRDBHXBVUVLJ-UHFFFAOYSA-N |