N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-(4-methylphenyl)ethan-1-amine
Chemical Structure Depiction of
N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-(4-methylphenyl)ethan-1-amine
N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-(4-methylphenyl)ethan-1-amine
Compound characteristics
| Compound ID: | E958-0978 |
| Compound Name: | N-({1-[5-(4-cyclohexylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-2-(4-methylphenyl)ethan-1-amine |
| Molecular Weight: | 464.68 |
| Molecular Formula: | C26 H36 N6 S |
| Smiles: | Cc1ccc(CCNCc2cccn2c2nnc(N3CCN(CC3)C3CCCCC3)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6845 |
| logD: | 3.864 |
| logSw: | -4.0896 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.055 |
| InChI Key: | RUOIBRJSCZAUOM-UHFFFAOYSA-N |