N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-(2-chlorophenyl)ethan-1-amine
Chemical Structure Depiction of
N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-(2-chlorophenyl)ethan-1-amine
N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-(2-chlorophenyl)ethan-1-amine
Compound characteristics
| Compound ID: | E958-1526 |
| Compound Name: | N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-(2-chlorophenyl)ethan-1-amine |
| Molecular Weight: | 415.99 |
| Molecular Formula: | C21 H26 Cl N5 S |
| Smiles: | C1CCCN(CC1)c1nnc(n2cccc2CNCCc2ccccc2[Cl])s1 |
| Stereo: | ACHIRAL |
| logP: | 4.9368 |
| logD: | 4.8546 |
| logSw: | -5.05 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.293 |
| InChI Key: | WEASRDAHTFFLJH-UHFFFAOYSA-N |