1-(3-methylphenyl)-N-({1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Chemical Structure Depiction of
1-(3-methylphenyl)-N-({1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
1-(3-methylphenyl)-N-({1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Compound characteristics
| Compound ID: | E958-0894 |
| Compound Name: | 1-(3-methylphenyl)-N-({1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine |
| Molecular Weight: | 353.49 |
| Molecular Formula: | C19 H23 N5 S |
| Smiles: | Cc1cccc(CNCc2cccn2c2nnc(N3CCCC3)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.1612 |
| logD: | 3.9848 |
| logSw: | -4.1586 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.486 |
| InChI Key: | JKNTVNNCMRUULJ-UHFFFAOYSA-N |