3-(azepan-1-yl)-N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)propan-1-amine
Chemical Structure Depiction of
3-(azepan-1-yl)-N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)propan-1-amine
3-(azepan-1-yl)-N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)propan-1-amine
Compound characteristics
| Compound ID: | E958-1502 |
| Compound Name: | 3-(azepan-1-yl)-N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)propan-1-amine |
| Molecular Weight: | 416.63 |
| Molecular Formula: | C22 H36 N6 S |
| Smiles: | C1CCCN(CC1)CCCNCc1cccn1c1nnc(N2CCCCCC2)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9078 |
| logD: | 1.833 |
| logSw: | -3.85 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.606 |
| InChI Key: | UPLGFHBWGDDWJP-UHFFFAOYSA-N |