2-(4-methylphenyl)-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-(4-methylphenyl)-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)ethan-1-amine
2-(4-methylphenyl)-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: | E958-0814 |
| Compound Name: | 2-(4-methylphenyl)-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)ethan-1-amine |
| Molecular Weight: | 458.63 |
| Molecular Formula: | C26 H30 N6 S |
| Smiles: | Cc1ccc(CCNCc2cccn2c2nnc(N3CCN(CC3)c3ccccc3)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6626 |
| logD: | 4.49 |
| logSw: | -4.252 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.222 |
| InChI Key: | RXKATGQEALEWTD-UHFFFAOYSA-N |