1-(5-{2-[(4-methylpiperidin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)azepane
Chemical Structure Depiction of
1-(5-{2-[(4-methylpiperidin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)azepane
1-(5-{2-[(4-methylpiperidin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)azepane
Compound characteristics
| Compound ID: | E958-1460 |
| Compound Name: | 1-(5-{2-[(4-methylpiperidin-1-yl)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)azepane |
| Molecular Weight: | 359.54 |
| Molecular Formula: | C19 H29 N5 S |
| Smiles: | CC1CCN(CC1)Cc1cccn1c1nnc(N2CCCCCC2)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3611 |
| logD: | 4.2296 |
| logSw: | -4.0912 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.418 |
| InChI Key: | DFQVQTANKDUDEK-UHFFFAOYSA-N |