1-(4-methylphenyl)-N-({1-[5-(4-methylpiperidin-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-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
1-(4-methylphenyl)-N-({1-[5-(4-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Compound characteristics
| Compound ID: | E958-0721 |
| Compound Name: | 1-(4-methylphenyl)-N-({1-[5-(4-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine |
| Molecular Weight: | 381.54 |
| Molecular Formula: | C21 H27 N5 S |
| Smiles: | CC1CCN(CC1)c1nnc(n2cccc2CNCc2ccc(C)cc2)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5298 |
| logD: | 4.2627 |
| logSw: | -4.1021 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.12 |
| InChI Key: | IPBAWMQXUJJXRS-UHFFFAOYSA-N |