1-(3-methoxyphenyl)-N-({1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Chemical Structure Depiction of
1-(3-methoxyphenyl)-N-({1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
1-(3-methoxyphenyl)-N-({1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Compound characteristics
| Compound ID: | E958-1312 |
| Compound Name: | 1-(3-methoxyphenyl)-N-({1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C20 H25 N5 O S |
| Smiles: | COc1cccc(CNCc2cccn2c2nnc(N3CCCCC3)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8733 |
| logD: | 2.9786 |
| logSw: | -3.9833 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.664 |
| InChI Key: | MFSJIFXIQOHMPM-UHFFFAOYSA-N |