2-phenyl-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)ethan-1-amine
Chemical Structure Depiction of
2-phenyl-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)ethan-1-amine
2-phenyl-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)ethan-1-amine
Compound characteristics
| Compound ID: | E958-0831 |
| Compound Name: | 2-phenyl-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)ethan-1-amine |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C25 H28 N6 S |
| Smiles: | C(CNCc1cccn1c1nnc(N2CCN(CC2)c2ccccc2)s1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2393 |
| logD: | 4.0666 |
| logSw: | -4.2726 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.222 |
| InChI Key: | BRKBBRLAIIZIOB-UHFFFAOYSA-N |