1-(5-{2-[(4-ethylpiperazin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)azepane
Chemical Structure Depiction of
1-(5-{2-[(4-ethylpiperazin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)azepane
1-(5-{2-[(4-ethylpiperazin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)azepane
Compound characteristics
Compound ID: | E958-1482 |
Compound Name: | 1-(5-{2-[(4-ethylpiperazin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)azepane |
Molecular Weight: | 374.55 |
Molecular Formula: | C19 H30 N6 S |
Smiles: | CCN1CCN(CC1)Cc1cccn1c1nnc(N2CCCCCC2)s1 |
Stereo: | ACHIRAL |
logP: | 3.1216 |
logD: | 2.1013 |
logSw: | -2.9047 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 36.955 |
InChI Key: | IEDIBJRWSUTWAY-UHFFFAOYSA-N |