1-benzyl-N-({1-[5-(4-methylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)piperidin-4-amine
Chemical Structure Depiction of
1-benzyl-N-({1-[5-(4-methylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)piperidin-4-amine
1-benzyl-N-({1-[5-(4-methylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)piperidin-4-amine
Compound characteristics
| Compound ID: | E958-1152 |
| Compound Name: | 1-benzyl-N-({1-[5-(4-methylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)piperidin-4-amine |
| Molecular Weight: | 451.64 |
| Molecular Formula: | C24 H33 N7 S |
| Smiles: | CN1CCN(CC1)c1nnc(n2cccc2CNC2CCN(CC2)Cc2ccccc2)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.7538 |
| logD: | 1.803 |
| logSw: | -2.8495 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.653 |
| InChI Key: | VPELZGGWRJAIIM-UHFFFAOYSA-N |