1-(4-methylphenyl)-N-({1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Chemical Structure Depiction of
1-(4-methylphenyl)-N-({1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
1-(4-methylphenyl)-N-({1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Compound characteristics
| Compound ID: | E958-1213 |
| Compound Name: | 1-(4-methylphenyl)-N-({1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine |
| Molecular Weight: | 410.58 |
| Molecular Formula: | C22 H30 N6 S |
| Smiles: | CCCN1CCN(CC1)c1nnc(n2cccc2CNCc2ccc(C)cc2)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.8296 |
| logD: | 2.9564 |
| logSw: | -3.7117 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.91 |
| InChI Key: | BDZSPQWNWJTYCH-UHFFFAOYSA-N |